SCHEMBL7189934

SCHEMBL7189934

N#Cc1ccc(Cc2nccn2Cc2ccc(-n3cc(Cl)ccc3=O)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.42
HSP90B1 P14625 1/20 0.42
CYP11B1 P15538 3/20 0.37
CYP11B2 P19099 3/20 0.37
KCNH2 Q12809 3/20 0.36
FNTA P49354 2/20 0.35
FNTB P49356 2/20 0.35
PGGT1B P53609 1/20 0.35
CYP19A1 P11511 5/20 0.35
TSHR P16473 1/20 0.35
BRD4 O60885 1/20 0.35

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
SCHEMBL8156637 0.88 HSP90AA1 (0.40) HSP90AA1HSP90B1CYP11B1CYP11B2CYP19A1
Hydrochloric Acid SCHEMBL8148674 0.87 HSP90AA1 (0.40) HSP90AA1HSP90B1CYP11B1CYP11B2CYP19A1
SCHEMBL6981310 0.86 HSP90AA1 (0.42) HSP90AA1HSP90B1CYP11B1CYP11B2CYP19A1
SCHEMBL1508003 0.82 CYP19A1 (0.50) HSP90AA1HSP90B1CYP11B1CYP11B2CYP19A1
SCHEMBL3498547 0.81 HDAC8 (0.39) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL8149819 0.79 HSP90AA1 (0.38) HSP90AA1HSP90B1CYP11B1CYP11B2CYP19A1
SCHEMBL4978567 0.78 HSP90AA1 (0.41) HSP90AA1HSP90B1CYP11B1CYP11B2FNTA
SCHEMBL30610947 0.77 CYP11B1 (0.48) HSP90AA1HSP90B1CYP11B1CYP11B2CYP19A1
SCHEMBL1507873 0.77 CYP11B1 (0.48) HSP90AA1HSP90B1CYP11B1CYP11B2CYP19A1
SCHEMBL8149037 0.77 HSP90AA1 (0.41) HSP90AA1HSP90B1CYP11B1CYP11B2FNTA

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
US-20030220241-A1 Method of treating cancer DEFEO-JONES DEBORAH (US) 2003-11-27 US disclosed
US-6077853-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 2000-06-20 US disclosed
EP-0951285-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-10-27 EP disclosed
WO-1998029119-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1998-07-09 WO 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-20030220241-A1 Method of treating cancer ACP3, PSAT1, LCAT HSP90AA1 1462/4885HSP90B1 549/4885CYP11B1 530/4885

“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.