SCHEMBL6319680

SCHEMBL6319680

O=C1Cc2c(cccc2-c2cccc(Cl)c2)N1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 3/20 0.58
TDP2 O95551 3/20 0.52
CCNB2 O95067 4/20 0.50
CDK1 P06493 4/20 0.50
CCNB1 P14635 4/20 0.50
GSK3B P49841 4/20 0.50
CCNB3 Q8WWL7 4/20 0.50
CDK5 Q00535 3/20 0.50
CDK5R1 Q15078 3/20 0.50
AHR P35869 2/20 0.49
CMA1 P23946 1/20 0.49
PIP4K2A P48426 1/20 0.46
PIP4K2B P78356 1/20 0.46
GRM2 Q14416 1/20 0.46
ABL1 P00519 1/20 0.46
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
CCNT1 O60563 1/20 0.41
CCNA2 P20248 1/20 0.41

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
SCHEMBL6324288 0.84 CCNB2 (0.49) PGRTDP2CCNB2CDK1CCNB1
SCHEMBL6328529 0.83 BRD4 (0.54) PGRTDP2CCNB2CDK1CCNB1
SCHEMBL6319302 0.83 CREBBP (0.59) PGRTDP2CCNB2CDK1CCNB1
SCHEMBL5843496 0.82 JAK2 (0.51) CCNB2CDK1CCNB1GSK3BCCNB3
SCHEMBL6321593 0.82 TDP2 (0.52) TDP2CCNB2CDK1CCNB1GSK3B
SCHEMBL155873 0.82 GSK3B (0.50) PGRTDP2CCNB2CDK1CCNB1
SCHEMBL10712645 0.82 TDP2 (0.52) TDP2CCNB2CDK1CCNB1GSK3B
SCHEMBL16090379 0.80 BRD4 (0.52) PGRTDP2CCNB2CDK1CCNB1
SCHEMBL6320773 0.78 TDP2 (0.55) TDP2CCNB2CDK1CCNB1GSK3B
SCHEMBL6320969 0.78 GSK3B (0.53) TDP2CCNB2CDK1CCNB1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6861418-B2 4-aryl substituted indolinones SUGEN, INC. (US) 2005-03-01 US disclosed
US-20040157909-A1 4-Aryl substituted indolinones SUGEN, INC. 2004-08-12 US disclosed
US-6677368-B2 4-aryl substituted indolinones SUGEN, INC. 2004-01-13 US disclosed
EP-1349852-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES Sugen, Inc. (US) 2003-10-08 EP disclosed
US-20030069297-A1 4-aryl substituted indolinones SUGEN, INC. 2003-04-10 US disclosed
WO-2002055517-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES CUI JINGRONG (US) 2002-07-18 WO disclosed
US-4670566-A ANTIIFLAMMATORY AGENTS, ANTICOAGULANTS A. H. ROBINS COMPANY, INCORPORATED (US) 1987-06-02 US disclosed
EP-0089426-B1 2-AMINO-6-BIPHENYLACETIC ACIDS A.H. ROBINS COMPANY, INCORPORATED (US) 1986-06-11 EP disclosed
US-4440785-A Methods of using 2-aminobiphenylacetic acids, esters, and metal salts thereof to treat inflammation A. H. ROBINS COMPANY, INC. (US) 1984-04-03 US disclosed
EP-0089426-A1 2-Amino-6-biphenylacetic acids A.H. ROBINS COMPANY, INCORPORATED (US) 1983-09-28 EP disclosed
US-4333951-A MUSCLE RELAXANTS, ANTIINFLAMMATORY AGENTS A. H. ROBINS COMPANY, INC. (US) 1982-06-08 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 (2 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-20030069297-A1 4-aryl substituted indolinones CDK5, CAMK4, TNK2 PGR 1080/4885TDP2 1952/4885CCNB2 694/4885
US-20040157909-A1 4-Aryl substituted indolinones CDK5, CAMK4, TNK2 PGR 1080/4885TDP2 1952/4885CCNB2 694/4885

“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.