SCHEMBL6286757

SCHEMBL6286757

COc1ccc(CNC(=O)Nc2ncc(C(C)C)s2)c(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.52
ALDH1A1 P00352 4/20 0.50
TSHR P16473 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CDK2 P24941 6/20 0.48
CDK5 Q00535 6/20 0.48
CCNE1 P24864 5/20 0.48
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
ATG4B Q9Y4P1 2/20 0.48
RPS6KB1 P23443 1/20 0.48
GSK3A P49840 1/20 0.48
GSK3B P49841 1/20 0.48
AURKB Q96GD4 1/20 0.48
KMT2A Q03164 1/20 0.47
MAOB P27338 1/20 0.46
CSF1R P07333 1/20 0.46
PDGFRB P09619 1/20 0.46

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
SCHEMBL6282609 0.92 ROCK2 (0.52) ROCK2ALDH1A1CDK2CDK5CCNE1
SCHEMBL6279197 0.86 CCNE1 (0.57) ROCK2ALDH1A1CDK2CDK5CCNE1
SCHEMBL6278437 0.84 GSK3B (0.66) ROCK2ALDH1A1CDK2CDK5CCNE1
SCHEMBL5835450 0.81 NPC1 (0.58) ALDH1A1TSHRNPSR1CDK2CDK5
SCHEMBL6285587 0.81 ATG4B (0.53) ROCK2ALDH1A1CDK2CDK5CCNE1
SCHEMBL6279193 0.81 ROCK2 (0.56) ROCK2ALDH1A1CDK2CDK5CCNE1
SCHEMBL6282804 0.81 ALDH1A1 (0.57) ROCK2ALDH1A1CDK2CDK5CCNE1
SCHEMBL5835765 0.81 GLS (0.60) ALDH1A1CDK2CDK5CCNE1RPS6KB1
SCHEMBL6285364 0.81 MAPT (0.56) ALDH1A1CDK2CDK5CCNE1GAA
SCHEMBL6288017 0.80 SMN1; SMN2 (0.52) ROCK2ALDH1A1CDK2CDK5CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PEVARELLO PAOLO (IT) 2004-08-12 US claimed
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 claimed
US-6863647-B2 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2005-03-08 US disclosed
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

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 ROCK2 1685/4885ALDH1A1 903/4885TSHR 627/4885
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents UCK2, ULK3, CDK2 ROCK2 1685/4885ALDH1A1 903/4885TSHR 627/4885

“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.