SCHEMBL6337231

SCHEMBL6337231

CCC(Nc1ccc(CC(=O)N(C)C)cc1)=C1C(=O)Nc2cc(OC)c(OC)cc21

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 6/20 0.45
RET P07949 4/20 0.43
BCHE P06276 2/20 0.37
ACHE P22303 2/20 0.37
EPHX2 P34913 1/20 0.36
EGFR P00533 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
GAA P10253 1/20 0.35
BRD4 O60885 1/20 0.35
BRD2 P25440 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
SCHEMBL6337227 1.00 CHEK1 (0.45) CHEK1RETBCHEACHEEPHX2
SCHEMBL7474775 0.89 RET (0.47) RETBCHEACHEEPHX2EGFR
SCHEMBL6329199 0.89 RET (0.47) RETBCHEACHEEPHX2EGFR
SCHEMBL6329207 0.89 RET (0.47) RETBCHEACHEEPHX2EGFR
SCHEMBL6332666 0.88 RET (0.45) CHEK1RETEPHX2GAA
SCHEMBL6332672 0.88 RET (0.45) CHEK1RETEPHX2GAA
SCHEMBL7473358 0.88 RET (0.45) CHEK1RETEPHX2GAA
SCHEMBL6330783 0.88 RET (0.44) CHEK1RETBCHEACHEEPHX2
SCHEMBL6330792 0.88 RET (0.44) CHEK1RETBCHEACHEEPHX2
SCHEMBL6337188 0.87 ROCK2 (0.43) CHEK1RETBCHEACHEEGFR

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
US-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-01-13 US disclosed
US-6794395-B1 Substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-09-21 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-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments CCNE1, CDK1, CCNI CHEK1 145/4885RET 154/4885BCHE 3889/4885

“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.