SCHEMBL7189941

SCHEMBL7189941

N#Cc1ccc(C(Cc2ccc(-n3cc(Cl)ccc3=O)cc2)c2ncc[nH]2)cc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.33
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 2/20 0.32
TDP2 O95551 1/20 0.31
TSHR P16473 1/20 0.31
ABCB1 P08183 1/20 0.31
P2RX3 P56373 1/20 0.30
CNR1 P21554 1/20 0.30
GPR142 Q7Z601 1/20 0.30

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
SCHEMBL8156634 0.88 S1PR1 (0.33) CYP19A1S1PR1S1PR3
Hydrochloric Acid SCHEMBL8148673 0.87 S1PR1 (0.33) CYP19A1S1PR1S1PR3
SCHEMBL3498549 0.83 DAO (0.32) CYP19A1ABCB1CNR1
SCHEMBL6437501 0.81 CYP19A1 (0.41) CYP19A1
SCHEMBL8149818 0.80 EGLN1 (0.35) CYP19A1
SCHEMBL8149036 0.78 EGLN1 (0.33) CYP19A1S1PR1S1PR3CNR1
SCHEMBL8157295 0.77 EGLN1 (0.33) CYP19A1
SCHEMBL8142506 0.77 CYP19A1 (0.38) CYP19A1
SCHEMBL8151901 0.75 CYP19A1 (0.34) CYP19A1
SCHEMBL3499500 0.73 CYP19A1 (0.33) CYP19A1S1PR1S1PR3

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 CYP19A1 368/4885S1PR1 2119/4885S1PR3 2198/4885

“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.