SCHEMBL6710801

SCHEMBL6710801

Cc1ccc2cc(N(C(N)=O)c3ncc(C(C)C)s3)ccc2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
POLB P06746 1/20 0.36
CASP6 P55212 1/20 0.36
CYP1A2 P05177 3/20 0.35
ALOX5 P09917 7/20 0.34
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
CCNE1 P24864 3/20 0.32
CDK2 P24941 3/20 0.32
CDK5 Q00535 3/20 0.32
MLYCD O95822 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTGES O14684 1/20 0.32
LTA4H P09960 1/20 0.32
GAA P10253 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
ALOX5AP P20292 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
SCHEMBL6715903 0.81 TRPA1 (0.35) LMNACYP1A2ALOX5CCNE1CDK2
SCHEMBL7257113 0.81 CDK2 (0.38) LMNACYP1A2ALOX5CCNE1CDK2
SCHEMBL27572548 0.81 CDK2 (0.38) LMNACYP1A2ALOX5CCNE1CDK2
SCHEMBL27570619 0.81 CDK2 (0.38) ALOX5CCNE1CDK2CDK5MLYCD
SCHEMBL6758493 0.80 NPC1 (0.39) KDM4ELMNAALOX5NPC1RAB9A
SCHEMBL27574287 0.80 CCNE1 (0.37) ALOX5CCNE1CDK2CDK5MLYCD
SCHEMBL6710898 0.80 MLYCD (0.38) ALOX5CCNE1CDK2CDK5MLYCD
SCHEMBL6711707 0.80 MLYCD (0.47) LMNACYP1A2ALOX5NPC1RAB9A
SCHEMBL6712094 0.79 ALDH1A1 (0.38) KDM4ELMNACCNE1CDK2CDK5
SCHEMBL6712093 0.79 MAOA (0.35) KDM4ELMNAALOX5CCNE1CDK2

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
CN-1325390-A 2-ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN claimed
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PEVARELLO PAOLO (IT) 2004-08-12 US disclosed
US-20030187040-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2003-10-02 US disclosed
CN-1325390-A 2-ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN 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-20030187040-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents UCK2, ULK3, CDK2 KDM4E 2087/4885LMNA 1246/4885POLB 2499/4885
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents UCK2, ULK3, CDK2 KDM4E 2087/4885LMNA 1246/4885POLB 2499/4885

“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.