SCHEMBL6286205

SCHEMBL6286205

COc1cccc(NC(=O)Nc2ncc(Br)s2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.62
NPC1 O15118 7/20 0.62
TP53 P04637 2/20 0.58
TSHR P16473 1/20 0.58
ALDH1A1 P00352 3/20 0.57
DYRK1A Q13627 1/20 0.57
HTT P42858 4/20 0.57
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
MAPT P10636 6/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
MITF O75030 1/20 0.54
USP2 O75604 1/20 0.54
GAA P10253 1/20 0.54
ALOX15 P16050 1/20 0.54
HSD17B10 Q99714 1/20 0.54
CDK8 P49336 1/20 0.53
CSNK2A2 P19784 1/20 0.53
CSNK2B P67870 1/20 0.53
CSNK2A1 P68400 1/20 0.53

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
SCHEMBL6278432 0.85 SMN1; SMN2 (0.60) RAB9ANPC1TP53TSHRALDH1A1
SCHEMBL6279306 0.83 CCNE1 (0.70) RAB9ANPC1TP53TSHRALDH1A1
SCHEMBL6279216 0.83 CNR1 (0.62) RAB9ANPC1TP53TSHRALDH1A1
SCHEMBL6287288 0.82 CCNE1 (0.62) RAB9ANPC1TP53TSHRALDH1A1
SCHEMBL6285669 0.82 DYRK1A (0.56) RAB9ANPC1TP53ALDH1A1DYRK1A
SCHEMBL4601039 0.82 MEN1 (0.54) RAB9ANPC1TSHRALDH1A1HTT
SCHEMBL6287753 0.81 FBP1 (0.65) RAB9ANPC1ALDH1A1HTTMEN1
SCHEMBL6285829 0.81 FBP1 (0.65) RAB9ANPC1ALDH1A1HTTMEN1
SCHEMBL960354 0.81 FBP1 (0.77)
SCHEMBL4715713 0.80 CDK2 (0.63) RAB9ANPC1TP53TSHRALDH1A1

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 RAB9A 2674/4885NPC1 2685/4885TP53 470/4885
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents UCK2, ULK3, CDK2 RAB9A 2674/4885NPC1 2685/4885TP53 470/4885

“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.