SCHEMBL6286071

SCHEMBL6286071

CC(C)c1cnc(NC(=O)Nc2ccc3[nH]ccc3c2)s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 7/20 0.60
CCNE1 P24864 6/20 0.60
CDK5 Q00535 6/20 0.60
EPHX1 P07099 2/20 0.47
MAOA P21397 2/20 0.46
MAOB P27338 1/20 0.46
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
MAPT P10636 3/20 0.45
PRKCI P41743 1/20 0.45
CCNT1 O60563 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CDK1 P06493 1/20 0.44
CDK4 P11802 1/20 0.44
CCNB1 P14635 1/20 0.44
CCNA2 P20248 1/20 0.44
CCND1 P24385 1/20 0.44
CDK7 P50613 1/20 0.44
CDK9 P50750 1/20 0.44
CCNH P51946 1/20 0.44

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
SCHEMBL6282877 0.91 CDK2 (0.60) CDK2CCNE1CDK5MAOARAB9A
SCHEMBL5836059 0.83 CCNE1 (0.59) CDK2CCNE1CDK5MAOAMAOB
SCHEMBL6286656 0.82 CDK2 (0.60) CDK2CCNE1CDK5EPHX1NPC1
SCHEMBL6286861 0.80 CDK2 (0.60) CDK2CCNE1CDK5NPC1RAB9A
SCHEMBL5780938 0.78 CCNE1 (0.66) CDK2CCNE1CDK5EPHX1NPC1
SCHEMBL6286119 0.78 CDK2 (0.67) CDK2CCNE1CDK5RAB9AMAPT
SCHEMBL6279196 0.78 CDK2 (0.60) CDK2CCNE1CDK5NPC1RAB9A
SCHEMBL22803696 0.78 NPC1 (0.67) EPHX1MAOAMAOBNPC1RAB9A
SCHEMBL6285271 0.77 CDK2 (0.78) CDK2CCNE1CDK5NPC1RAB9A
SCHEMBL22803315 0.77 MAOA (0.58) EPHX1MAOAMAOBNPC1RAB9A

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 CDK2 3/4885CCNE1 83/4885CDK5 129/4885
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents UCK2, ULK3, CDK2 CDK2 3/4885CCNE1 83/4885CDK5 129/4885

“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.