SCHEMBL6941635

SCHEMBL6941635

COC(=O)C(N)(Cc1cncn1C)Cc1cncn1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.34
CYP11B2 P19099 5/20 0.34
CHRM5 P08912 3/20 0.34
PIK3CA P42336 1/20 0.33
PIK3CG P48736 1/20 0.33
OPRM1 P35372 1/20 0.33
CHRM4 P08173 2/20 0.33
CHRM1 P11229 2/20 0.33
CYP2C9 P11712 2/20 0.33
CHRM3 P20309 2/20 0.33
CHRM2 P08172 1/20 0.33
CYP2A6 P11509 1/20 0.33
CNR1 P21554 1/20 0.33
HTR2A P28223 1/20 0.33
CYP2A13 Q16696 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL9372232 0.71 CHRM5 (0.41) CHRM5CHRM4CHRM1CYP2C9CHRM3
SCHEMBL23480895 0.70 CYP11B1 (0.36) CYP11B1CYP11B2CHRM5OPRM1CHRM4
SCHEMBL29063413 0.70 CYP11B1 (0.36) CYP11B1CYP11B2CHRM5OPRM1CHRM4
SCHEMBL13733705 0.69 MAPK1 (0.42) CHRM5CYP3A4MAPK1
SCHEMBL10190927 0.69 CHRM5 (0.39) CHRM5CHRM4CHRM1CYP2C9CHRM3
SCHEMBL2892358 0.68 CHRM5 (0.43) CHRM5CHRM4CHRM1CYP2C9CHRM3
SCHEMBL20671646 0.68 RECQL (0.42) CHRM5CHRM4CHRM1CYP2C9CHRM3
SCHEMBL6642477 0.68 PTPRB (0.51) CYP2A6MEN1CYP1A2CYP3A4CYP2C19
SCHEMBL874048 0.66 CHRM5 (0.41) CHRM5CHRM4CHRM1CYP2C9CHRM3
Trifluoroacetic Acid SCHEMBL1311021 0.66 CYP11B1 (0.53) CYP11B1CYP11B2PIK3CAPIK3CGMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0928788-B1 Imidazolidin-4-one derivatives useful as anticancer agents PFIZER PROD INC (US) 2003-02-12 EP disclosed
US-6194438-B1 ANTITUMOR AGENTS; ANTICANCER AGENTS; FARNESYL-PROTEIN TRANSFERASE INHIBITOR PFIZER INC. 2001-02-27 US disclosed
US-6174903-B1 INHIBITORS OF THE ENZYME FARNESYL PROTEIN TRANSFERASE AND ARE THEREFORE CAN BE USED AS ANTICANCER AGENT AND ANTITUMOR AGENT PFIZER INC. 2001-01-16 US disclosed
US-6080769-A Imidazolidin-4-one derivatives useful as anticancer agents PFIZER INC. (US) 2000-06-27 US disclosed
EP-1006113-A1 Derivatives of 2-(2-oxo-ethylidene)-imidazolidin-4-one and their use to inhibit abnormal cell growth Pfizer Products Inc. (US) 2000-06-07 EP disclosed
EP-0928788-A1 Imidazolidin-4-one derivatives useful as anticancer agents Pfizer Products Inc. (US) 1999-07-14 EP disclosed