SCHEMBL2173469

SCHEMBL2173469

O=C(Cl)Cc1ccc(F)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.44
SIGMAR1 Q99720 2/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
PIK3CA P42336 1/20 0.41
RIPK1 Q13546 1/20 0.41
KCNQ2 O43526 1/20 0.41
HTT P42858 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
DAO P14920 1/20 0.38
NAMPT P43490 1/20 0.37

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
SCHEMBL1150357 0.84 MAPT (0.44) PIK3CAKCNQ2
SCHEMBL21090110 0.84 PIK3CA (0.58) PIK3CAALDH1A1HDAC1DAO
SCHEMBL6864288 0.83 CES2 (0.46) MAPK8SIGMAR1CES2CES1MAOA
SCHEMBL4108950 0.82 KMT2A (0.44) KCNQ2HTTALDH1A1HDAC1DAO
SCHEMBL4691645 0.82 CYP1A2 (0.42) MAOAMAOBPIK3CAALDH1A1HDAC1
SCHEMBL12672485 0.82 MMP13 (0.47) PIK3CAALDH1A1HDAC1HDAC8DAO
SCHEMBL154429 0.81 KDM4E (0.55) MAPK8CES2CES1MAOAMAOB
SCHEMBL28501277 0.80 MAPK8 (0.42) MAPK8SIGMAR1CES2CES1MAOA
SCHEMBL1874608 0.80 DAO (0.42) MAPK8CES2CES1MAOAMAOB
SCHEMBL5200711 0.80 KIF11 (0.50) KCNQ2DAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3206057-A None JP disclosed
JP-3206055-A None JP disclosed
CN-119823019-A Indole compound with effect of treating idiopathic pulmonary fibrosis as well as preparation method and application thereof 沈阳药科大学 2025-04-15 CN disclosed
US-20240316043-A1 BROMODOMAIN INHIBITORS FOR CANCER THERAPY UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2024-09-26 US disclosed
WO-2024178304-A1 KRAS MODULATORS ALTEROME THERAPEUTICS, INC. (US) 2024-08-29 WO disclosed
CN-116715634-A Compound, pharmaceutical composition and application thereof in preparation of vasodilation drugs 山东第一医科大学(山东省医学科学院) 2023-09-08 CN disclosed
WO-2018184976-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINECARBOXAMIDES AND USE OF SAME BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-10-11 WO disclosed
EP-2346865-B1 INDOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS MERCK CANADA INC (CA) 2015-07-15 EP disclosed
US-8637671-B2 Indole derivatives as CRTH2 receptor antagonists MERCK CANADA INC. (CA) 2014-01-28 US disclosed
US-8299075-B2 Substituted thiomorpholine derivatives H. LUNDBECK A/S (DK) 2012-10-30 US disclosed
WO-2002016343-A1 TETRAHYDROPYRAN DERIVATIVES AS NK-1 RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 2002-02-28 WO disclosed
WO-2002016344-A1 TETRAHYDROPYRAN DERIVATIVES AS NK-1 RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 2002-02-28 WO disclosed
WO-2001096299-A2 INDOLE DERIVATIVES AND THEIR USE AS 15-LIPOXYGENASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-12-20 WO disclosed
EP-1140906-A1 IMIDAZOLONES AND THEIR USE IN TREATING BENIGN PROSTATIC HYPERPLASIA AND OTHER DISORDERS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2001-10-10 EP disclosed
WO-2000035907-A1 IMIDAZOLONES AND THEIR USE IN TREATING BENIGN PROSTATIC HYPERPLASIA AND OTHER DISORDERS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-06-22 WO disclosed
US-6046331-A Imidazolones and their use in treating benign prostatic hyperplasia and other disorders SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-04-04 US disclosed
JP-H03206057-A LIQUID CRYSTALLINE COMPOUND OF TOLANE-TYPE CHISSO CORP 1991-09-09 JP disclosed
JP-H03206055-A LIQUID CRYSTALLINE COMPOUND AND LIQUID CRYSTALLINE COMPOSITION SEIKO EPSON CORP 1991-09-09 JP disclosed
US-4839091-A SUPERIOR COMPATIBILITY AT LOW TEMPERATURES; LARGE OPTICAL ANISOTROPY CHISSO CORPORATION (JP) 1989-06-13 US disclosed
EP-0295602-A1 Tolan derivative and liquid crystal composition containing the same Chisso Corporation (JP) 1988-12-21 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 (1 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-20240316043-A1 BROMODOMAIN INHIBITORS FOR CANCER THERAPY BRDT, BRD4, BRD3 MAPK8 1265/4885SIGMAR1 3427/4885CES2 1694/4885

“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.