SCHEMBL4970322

SCHEMBL4970322

Cc1cc(Cl)cc2c1OC(c1ccccc1)CN2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ABCG2 Q9UNQ0 2/20 0.36
ABCB1 P08183 1/20 0.36
CYP19A1 P11511 2/20 0.35
POLB P06746 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PABPC1 P11940 1/20 0.33
APEX1 P27695 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
EIF4H Q15056 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAOB P27338 3/20 0.33
SLC6A3 Q01959 2/20 0.33
TSHR P16473 1/20 0.33
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32

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
SCHEMBL4970711 0.80 BRD4 (0.42) ABCG2ABCB1CYP19A1MAOBTSHR
SCHEMBL4971664 0.75 ADAMTS5 (0.42) ATMSMN1; SMN2ABCG2ABCB1CYP19A1
SCHEMBL4968442 0.72 NISCH (0.40) ATMSMN1; SMN2CYP19A1MEN1GAA
SCHEMBL2399683 0.70 TSHR (0.45) CYP19A1MAOBTSHR
SCHEMBL2362658 0.70 MAOB (0.54) CYP19A1MAPTMAOBKIF11
SCHEMBL4969411 0.70 MAOB (0.50) SMN1; SMN2CYP19A1GAAMAPTKMT2A
SCHEMBL4971354 0.68 F2 (0.37) CYP19A1TSHRKIF11CYP3A4
SCHEMBL9177187 0.67 NISCH (0.58) CYP19A1MEN1GAAMAPTKMT2A
SCHEMBL30991556 0.65 MAOB (0.41) SMN1; SMN2CYP19A1MAPTMAOBTSHR
SCHEMBL6981999 0.64 ABCG2 (0.56) ABCG2ABCB1CYP19A1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1985297-A1 CARBOXYLIC ACID COMPOUND AND USE THEREOF Japan Tobacco, Inc. (JP) 2008-10-29 EP disclosed
US-20070197512-A1 Carboxylic Acid Compounds and Use Thereof JAPAN TOBACCO INC. (JP) 2007-08-23 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-20070197512-A1 Carboxylic Acid Compounds and Use Thereof GLS, SLC10A1, SOAT1 ATM 4501/4885SMN1; SMN2 4151/4885ABCG2 151/4885

“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.