SCHEMBL2763855

SCHEMBL2763855

Br[Mg]CCC1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
SIGMAR1 Q99720 3/20 0.39
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
BRCA1 P38398 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
METAP1 P53582 1/20 0.32
CHRM5 P08912 2/20 0.32
ADRA2C P18825 1/20 0.32
CHRM2 P08172 1/20 0.32

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
SCHEMBL4182684 0.97
SCHEMBL6711921 0.86
SCHEMBL7440404 0.85 CYP1A2 (0.56) CYP1A2SIGMAR1EPHX1CEL
SCHEMBL8838698 0.83 CYP1A2 (0.54) CYP1A2SIGMAR1MAPTEPHX1CEL
SCHEMBL11651890 0.82 CYP1A2 (0.52) CYP1A2SIGMAR1EPHX1
SCHEMBL9670510 0.81 SIGMAR1 (0.54) CYP1A2SIGMAR1MAPTEPHX1
SCHEMBL8417237 0.75 CYP1A2 (0.39) CYP1A2MEN1ALDH1A1LMNAMAPT
SCHEMBL8415898 0.75 CYP1A2 (0.34) CYP1A2
SCHEMBL8417235 0.75 CYP1A2 (0.39) CYP1A2MEN1ALDH1A1LMNAMAPT
SCHEMBL8106998 0.74 CYP1A2 (0.42) CYP1A2SIGMAR1HPGDKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4647432-A1 AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR LAYER, AND ORGANIC THIN FILM TRANSISTOR Tosoh Corporation (JP) 2025-11-12 EP disclosed
WO-2024162378-A1 AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR LAYER, AND ORGANIC THIN FILM TRANSISTOR 東ソー株式会社 2024-08-08 WO disclosed
CN-107531693-B 5 or 8-substituted imidazo [1, 5-a ] pyridines as indoleamine, tryptophan dioxygenase inhibitors 百济神州有限公司 2021-07-06 CN disclosed
EP-3280715-B1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO [1, 5-a]PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2, 3-DIOXYGENASES BEIGENE LTD (KY) 2020-11-25 EP disclosed
WO-2020193649-A1 NEW THERAPEUTIC APPLICATION OF 1,2-DIOXOLANE-3,5-DISUBSTITUTED COMPOUNDS, AND METHOD FOR THE PRODUCTION THEREOF Universite Paris-Saclay (FR) 2020-10-01 WO disclosed
WO-2020193650-A1 PROCESS FOR PREPARING 1,2-ENDOPEROXIDE COMPOUNDS Universite Paris-Saclay (FR) 2020-10-01 WO disclosed
US-10647714-B2 5 or 8-substituted imidazo[1,5-a]pyridines as indoleamine and/or tryptophane 2,3-dioxygenases BEIGENE, LTD. (KY) 2020-05-12 US disclosed
CN-110872289-A Novel 8-substituted imidazo [1,5-a ] pyridines as IDO1 and/or TDO inhibitors 百济神州(北京)生物科技有限公司 2020-03-10 CN disclosed
US-20190284184-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO[1,5-a]PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2,3-DIOXYGENASES BEONE MEDICINES I GMBH (CH) 2019-09-19 US disclosed
US-10280163-B2 5 or 8-substituted imidazo[1, 5-a] pyridines as indoleamine and/or tryptophane 2, 3-dioxygenases BEIGENE, LTD. (KY) 2019-05-07 US disclosed
US-5641765-A TREATS PROSTATIC ADENOCARCINOMA, BENIGN PROSTATE HYPERTROPHY; ANTAGONSIT, ANTAGONISM SMITHKLINE BEECHAM CORPORATION (US) 1997-06-24 US disclosed
US-5618806-A STEROID 5ALPHA-REDUCTASE INHIBITOR; USEFUL FOR TREATING BENIGN PROSTATIC HYPERTROPHY, BALDNESS, ACNE, VULGURIS, SEBORRHEA, FEMALE HIRSUTISM, AND PROSTATIC ADENOCARCINOMA SMITHKLINE BEECHAM CORPORATION 1997-04-08 US disclosed
EP-0669932-A4 17-ALPHA AND 17-BETA SUBSTITUTED ACYL-3-CARBOXY-3,5-DIENES AND USE IN INHIBITING 5-ALPHA-REDUCTASE. SMITHKLINE BEECHAM CORP (US) 1995-10-25 EP disclosed
EP-0638090-A4 17-g(a) AND 17-g(b)-SUBSTITUTED ESTRA-1,3,5(10)-TRIENE-3-CARBOXYLIC ACID. SMITHKLINE BEECHAM CORP (US) 1995-10-04 EP disclosed
EP-0669932-A1 17-ALPHA AND 17-BETA SUBSTITUTED ACYL-3-CARBOXY-3,5-DIENES AND USE IN INHIBITING 5-ALPHA-REDUCTASE SMITHKLINE BEECHAM CORPORATION (US) 1995-09-06 EP disclosed
EP-0638090-A1 17$g(a) AND 17$g(b)-SUBSTITUTED ESTRA-1,3,5(10)-TRIENE-3-CARBOXYLIC ACID SMITHKLINE BEECHAM CORPORATION (US) 1995-02-15 EP disclosed
WO-1994011386-A1 17-ALPHA AND 17-BETA SUBSTITUTED ACYL-3-CARBOXY-3,5-DIENES AND USE IN INHIBITING 5-ALPHA-REDUCTASE SMITHKLINE BEECHAM CORPORATION (US) 1994-05-26 WO disclosed
WO-1993022333-A1 17α AND 17β-SUBSTITUTED ESTRA-1,3,5(10)-TRIENE-3-CARBOXYLIC ACID SMITHKLINE BEECHAM CORPORATION (US) 1993-11-11 WO disclosed
US-4652551-A PEPTIDE, HYPOTENSIVE ABBOTT LABORATORIES (US) 1987-03-24 US disclosed
EP-0172346-A2 Renin inhibiting compounds ABBOTT LABORATORIES (US) 1986-02-26 EP 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 (3 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-10280163-B2 5 or 8-substituted imidazo[1, 5-a] pyridines as indoleamine and/or tryptophane 2, 3-dioxygenases IDO1, TPH1, IDO2 CYP1A2 66/4885SIGMAR1 2570/4885HPGD 113/4885
US-10647714-B2 5 or 8-substituted imidazo[1,5-a]pyridines as indoleamine and/or tryptophane 2,3-dioxygenases IDO1, TPH1, IDO2 CYP1A2 66/4885SIGMAR1 2570/4885HPGD 113/4885
US-20190284184-A1 NOVEL 5 OR 8-SUBSTITUTED IMIDAZO[1,5-a]PYRIDINES AS INDOLEAMINE AND/OR TRYPTOPHANE 2,3-DIOXYGENASES IDO1, TPH1, IDO2 CYP1A2 72/4885SIGMAR1 2396/4885HPGD 108/4885

“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.