SCHEMBL6287957

SCHEMBL6287957

CC(C)c1cnc(NC(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)s1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 4/20 0.53
CYP2C9 P11712 3/20 0.53
GAA P10253 2/20 0.53
CYP1A2 P05177 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HSD17B10 Q99714 1/20 0.53
ALDH1A1 P00352 2/20 0.52
BLM P54132 1/20 0.52
POLB P06746 2/20 0.50
HSD11B1 P28845 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 1/20 0.47
CCNE1 P24864 2/20 0.47
CDK2 P24941 2/20 0.47
CDK5 Q00535 2/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 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
SCHEMBL7083762 0.85 CDK2 (0.49) CCNE1CDK2CDK5
SCHEMBL6288095 0.83 CDK2 (0.46) ALDH1A1SMN1; SMN2CCNE1CDK2CDK5
SCHEMBL7837765 0.81 CCNE1 (0.45) CYP2C19CYP2C9ALDH1A1SMN1; SMN2CCNE1
SCHEMBL6285598 0.81 PANK3 (0.58) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL6286647 0.80 CDK2 (0.58) ALDH1A1SMN1; SMN2CCNE1CDK2CDK5
SCHEMBL5835551 0.76 CDK2 (0.75) ALDH1A1SMN1; SMN2KDM4ECCNE1CDK2
SCHEMBL6282734 0.75 CDK2 (0.61) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL27570633 0.75 CDK2 (0.61) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL6209558 0.75 CYP2C19 (0.81) CYP2C19CYP2C9GAACYP1A2MEN1
SCHEMBL6283976 0.74 CDK2 (0.59) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E

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 CYP2C19 3800/4885CYP2C9 3808/4885GAA 3569/4885
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents UCK2, ULK3, CDK2 CYP2C19 3800/4885CYP2C9 3808/4885GAA 3569/4885

“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.