SCHEMBL7013344

SCHEMBL7013344

c1ccc(Oc2ccc(-c3cccnc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 4/20 0.60
CYP11B1 P15538 3/20 0.60
CYP2A6 P11509 3/20 0.58
CYP3A4 P08684 2/20 0.58
ALDH1A1 P00352 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP19A1 P11511 5/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
CYP17A1 P05093 2/20 0.55
MKNK1 Q9BUB5 2/20 0.53
MKNK2 Q9HBH9 2/20 0.53
LTA4H P09960 2/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
PSMB5 P28074 1/20 0.52
KIF11 P52732 1/20 0.50
LMNA P02545 1/20 0.50

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
Diphenylether SCHEMBL29220492 0.94 CYP2A6 (0.65) CYP11B2CYP11B1CYP2A6CYP3A4ALDH1A1
SCHEMBL21882447 0.90 MAPT (0.55) CYP11B2CYP11B1CYP2A6CYP3A4ALDH1A1
SCHEMBL21882446 0.87 CYP2A6 (0.54) CYP11B2CYP11B1CYP2A6CYP3A4ALDH1A1
SCHEMBL29468039 0.85 CYP2A6 (0.79) CYP11B2CYP11B1CYP2A6CYP3A4ALDH1A1
SCHEMBL3400752 0.85 CYP2A6 (0.79) CYP11B2CYP11B1CYP2A6CYP3A4ALDH1A1
SCHEMBL25985498 0.85 CYP11B2 (0.53) CYP11B2CYP11B1CYP2A6CYP3A4ALDH1A1
SCHEMBL25985506 0.85 CYP11B2 (0.53) CYP11B2CYP11B1CYP2A6CYP3A4ALDH1A1
SCHEMBL21345924 0.85 CYP3A4 (0.57) CYP11B2CYP11B1CYP2A6CYP3A4ALDH1A1
SCHEMBL25985458 0.84 CYP19A1 (0.55) CYP11B2CYP11B1CYP3A4ALDH1A1CYP19A1
SCHEMBL27968872 0.84 LMNA (0.69) CYP11B2CYP11B1ALDH1A1CYP19A1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11491153-B2 Methods for treating cancer using pyrimidine and pyridine compounds with BTK inhibitory activity MERCK PATENT GMBH (DE) 2022-11-08 US disclosed
CN-1147492-C New metal protease inhibitors, its preparing method and their medicinal composition containing them ɪά��ʵ���� 2004-04-28 CN disclosed
EP-1065209-B1 Metalloprotease inhibitors, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-05-02 EP disclosed
US-6339092-B1 FOR THERAPY RHEUMATOID ARTHRITIS, ARTHROSIS, TUMOUR INVASION AND GROWTH, INCLUDING MALIGNANT SPREAD AND THE FORMATION OF METASTASES, ULCERATIONS, ATHEROSCLEROSIS ADIR ET COMPAGNIE (FR) 2002-01-15 US disclosed
EP-1065209-A1 Metalloprotease inhibitors, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-01-03 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-11491153-B2 Methods for treating cancer using pyrimidine and pyridine compounds with BTK inhibitory activity BTK, SYK, LCK CYP11B2 4418/4885CYP11B1 4206/4885CYP2A6 3780/4885

“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.