SCHEMBL621963

SCHEMBL621963

Cl[Zn]Cc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.50
LMNA P02545 1/20 0.47
CYP2A6 P11509 1/20 0.47
TAAR1 Q96RJ0 2/20 0.46
AGXT P21549 2/20 0.44
SLC6A4 P31645 2/20 0.44
SLC6A2 P23975 2/20 0.41
SLC6A3 Q01959 2/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
HTR2B P41595 1/20 0.41
CHRNA4 P43681 1/20 0.41
MAOB P27338 3/20 0.40
APP P05067 1/20 0.40
MAPK1 P28482 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1452910 0.74 IDO1 (0.48) IDO1LMNACYP2A6TAAR1AGXT
SCHEMBL852178 0.74 IDO1 (0.48) IDO1LMNATAAR1AGXTMAOB
SCHEMBL1444597 0.74 IDO1 (0.48) IDO1LMNACYP2A6TAAR1AGXT
SCHEMBL2821261 0.74 CYP2A6 (0.44) IDO1CYP2A6TAAR1HTR2AMAOB
SCHEMBL29892302 0.73
SCHEMBL1106684 0.71 IDO1 (0.58) IDO1LMNACYP2A6TAAR1AGXT
SCHEMBL2135113 0.71 TAAR1 (0.68) IDO1LMNACYP2A6TAAR1AGXT
Hydrochloric Acid SCHEMBL2271064 0.71 CALM1 (0.45) IDO1CYP2A6TAAR1AGXTHTR2A
Bromide SCHEMBL1444600 0.71 CALM1 (0.45) IDO1CYP2A6TAAR1HTR2AMAOB
SCHEMBL622228 0.70 IDO1 (0.56) IDO1TAAR1SLC6A4SLC6A2SLC6A3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 85 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025242747-A1 MULTI -COMPONENT FORMULATIONS OF ORGANOMETALLIC REAGENTS MERCK PATENT GMBH (DE) 2025-11-27 WO disclosed
US-20240199607-A1 BICYCLIC HETEROCYCLE COMPOUNDS AND THEIR USES IN THERAPY ASTEX THERAPEUTICS LIMITED (GB) 2024-06-20 US disclosed
US-11866428-B2 Bicyclic heterocycle compounds and their uses in therapy ASTEX THERAPEUTICS LIMITED (GB) 2024-01-09 US disclosed
US-20210122749-A1 BICYCLIC HETEROCYCLE COMPOUNDS AND THEIR USES IN THERAPY ASTEX THERAPEUTICS LIMITED (GB) 2021-04-29 US disclosed
US-20210002251-A1 Bruton's Tyrosine Kinase Inhibitors PFIZER INC. (US) 2021-01-07 US disclosed
EP-2699562-B1 BICYCLIC HETEROCYCLE COMPOUNDS AND THEIR USES IN THERAPY ASTEX THERAPEUTICS LTD (GB) 2020-12-23 EP disclosed
US-10815213-B2 Bruton's tyrosine kinase inhibitors PFIZER INC. (US) 2020-10-27 US disclosed
US-20190202798-A1 Bruton's Tyrosine Kinase Inhibitors PFIZER INC. (US) 2019-07-04 US disclosed
US-10266513-B2 Bruton's tyrosine kinase inhibitors PFIZER INC. (US) 2019-04-23 US disclosed
US-10144742-B2 Quinoxaline compounds and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2018-12-04 US disclosed
EP-1615905-A2 BENZOPYRAN COMPOUNDS USEFUL FOR TREATING INFLAMMATORY CONDITIONS Pharmacia Corporation (US) 2006-01-18 EP disclosed
WO-2005105777-A1 SUBSTITUTED THIOPHENE AMIDE COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA & UPJOHN COMPANY LLC (US) 2005-11-10 WO disclosed
US-20050148627-A1 Benzopyran compounds for use in the treatment and prevention of inflammation related conditions CARTER JEFFERY (US) 2005-07-07 US disclosed
US-20050148777-A1 Benzopyran compounds useful for treating inflammatory conditions CARTER JEFFERY (US) 2005-07-07 US disclosed
US-20040267011-A1 Methods for synthesis of diarylmethanes DANA-FARBER CANCER INSTITUTE 2004-12-30 US disclosed
WO-2004087687-A1 CHROMENE DERIVATIVES AS ANTI-INFLAMMATORY AGENTS PHARMACIA CORPORATION (US) 2004-10-14 WO disclosed
WO-2004087686-A2 BENZOPYRAN COMPOUNDS USEFUL FOR TREATING INFLAMMATORY CONDITIONS PHARMACIA CORPORATION (US) 2004-10-14 WO disclosed
WO-2003031458-A1 METHODS FOR SYNTHESIS OF DIARYLMETHANES DANA-FARBER CANCER INSTITUTE (US) 2003-04-17 WO disclosed
US-5498750-A Process for the preparation of 1-fluoro-cyclopropane-1-carboxylic acid BAYER AKTIENGESELLSCHAFT (DE) 1996-03-12 US disclosed
US-5434303-A Process for the preparation of 1-fluoro-cyclopropane-1-carboxylic acid BAYER AKTIENGESELLSCHAFT (DE) 1995-07-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10266513-B2 Bruton's tyrosine kinase inhibitors BTK, LCK, LYN IDO1 595/4885LMNA 4038/4885CYP2A6 2845/4885
US-20050148777-A1 Benzopyran compounds useful for treating inflammatory conditions PTGES2, PTGER2, PTGS2 IDO1 286/4885LMNA 3346/4885CYP2A6 175/4885
US-20040267011-A1 Methods for synthesis of diarylmethanes DHFR, DPYD, DHODH IDO1 277/4885LMNA 3339/4885CYP2A6 103/4885
US-10144742-B2 Quinoxaline compounds and uses thereof NAMPT, NQO2, NNMT IDO1 55/4885LMNA 3814/4885CYP2A6 2902/4885
US-20240199607-A1 BICYCLIC HETEROCYCLE COMPOUNDS AND THEIR USES IN THERAPY H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNB1, CCNE1 IDO1 2313/4885LMNA 646/4885CYP2A6 684/4885
US-10815213-B2 Bruton's tyrosine kinase inhibitors BTK, LCK, LYN IDO1 697/4885LMNA 4047/4885CYP2A6 2248/4885
US-20210002251-A1 Bruton's Tyrosine Kinase Inhibitors BTK, LCK, LYN IDO1 697/4885LMNA 4047/4885CYP2A6 2248/4885
US-20210122749-A1 BICYCLIC HETEROCYCLE COMPOUNDS AND THEIR USES IN THERAPY H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNB1, CCNE1 IDO1 2313/4885LMNA 646/4885CYP2A6 684/4885
US-11866428-B2 Bicyclic heterocycle compounds and their uses in therapy H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNB1, CCNE1 IDO1 2313/4885LMNA 646/4885CYP2A6 684/4885
US-20190202798-A1 Bruton's Tyrosine Kinase Inhibitors BTK, LCK, SYK IDO1 694/4885LMNA 4037/4885CYP2A6 2102/4885
US-20050148627-A1 Benzopyran compounds for use in the treatment and prevention of inflammation related conditions PTGES2, PTGER2, PTGES IDO1 329/4885LMNA 2102/4885CYP2A6 99/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.