SCHEMBL5236865

SCHEMBL5236865

CCOC(=O)c1c(O)c2ccc(Cl)cc2c(=O)n1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
ALOX15 P16050 6/20 0.47
KDM4E B2RXH2 3/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 2/20 0.47
HPGD P15428 1/20 0.47
CASP1 P29466 1/20 0.47
MAOB P27338 1/20 0.46
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
MEN1 O00255 1/20 0.43
MAPK10 P53779 1/20 0.43
KMT2A Q03164 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43

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
SCHEMBL5239340 0.95 ALDH1A1 (0.54) ALDH1A1ALOX15KDM4ETSHRHSD17B10
SCHEMBL5236351 0.85 BAZ2B (0.45) ALDH1A1ALOX15KDM4ETSHRHSD17B10
SCHEMBL5235496 0.85 ALDH1A1 (0.46) ALDH1A1ALOX15KDM4ETSHRHSD17B10
SCHEMBL5236655 0.82 ALDH1A1 (0.46) ALDH1A1ALOX15KDM4ETSHRHSD17B10
SCHEMBL5230696 0.82 ALDH1A1 (0.55) ALDH1A1TSHRHSD17B10HPGDCYP1A2
SCHEMBL5320510 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15KDM4ETSHRHSD17B10
SCHEMBL5240050 0.80 MAOB (0.45) ALDH1A1ALOX15KDM4ETSHRHSD17B10
SCHEMBL5239475 0.80 ALDH1A1 (0.44) ALDH1A1ALOX15KDM4ETSHRHSD17B10
SCHEMBL5239006 0.79 GABRA1 (0.44) ALDH1A1ALOX15KDM4ETSHRHSD17B10
SCHEMBL5233063 0.78 TACR1 (0.46) ALDH1A1ALOX15KDM4ETSHRHSD17B10

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1355886-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2007-07-11 EP disclosed
US-7034039-B2 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-25 US disclosed
CN-1500080-A Fused heterocyclic compounds ����ҩƷ��ҵ��ʽ���� 2004-05-26 CN disclosed
US-20040082607-A1 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-29 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 (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-20040082607-A1 Fused heterocyclic compounds DPP7, DPP4, METAP1 ALDH1A1 387/4885ALOX15 1616/4885KDM4E 897/4885

“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.