SCHEMBL6629885

SCHEMBL6629885

O=C1NC(=O)c2c1c1c(c3[nH]c4ccc(Br)cc4c23)Cc2ccccc2-1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 6/20 0.63
CCND1 P24385 6/20 0.63
CCNE2 O96020 5/20 0.63
CCNE1 P24864 5/20 0.63
CDK2 P24941 5/20 0.63
CCNB2 O95067 4/20 0.63
CDK1 P06493 4/20 0.63
CCNB1 P14635 4/20 0.63
CCNB3 Q8WWL7 4/20 0.63
MAP3K9 P80192 3/20 0.60
MAP3K10 Q02779 3/20 0.60
MAP3K11 Q16584 3/20 0.60
PRKD3 O94806 3/20 0.60
PRKCG P05129 3/20 0.60
PRKCB P05771 3/20 0.60
PRKCA P17252 3/20 0.60
PRKCH P24723 3/20 0.60
PRKCI P41743 3/20 0.60
PRKCE Q02156 3/20 0.60
PRKCQ Q04759 3/20 0.60

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
SCHEMBL6631769 0.91 CDK4 (0.63) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL6632580 0.87 CDK4 (0.63) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL3075228 0.86 MAP3K9 (0.80) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL3268039 0.85 MAP3K9 (0.76) CDK4CCND1MAP3K9MAP3K10MAP3K11
SCHEMBL14356196 0.83 MAP3K9 (0.62) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8806204 0.80 KDR (0.45) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL8127688 0.79 CDK4 (0.86) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL6630190 0.76 CDK4 (0.62) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL6627743 0.76 PRKD3 (0.65) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL7354146 0.76 MAP3K9 (0.68) CDK4CCND1CCNE2CCNE1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1088823-B1 Fused pyrrolocarbazoles CEPHALON INC (US) 2004-12-29 EP disclosed
EP-0785938-B1 FUSED PYRROLOCARBAZOLES CEPHALON INC (US) 2002-01-02 EP disclosed
EP-1088823-A1 Fused pyrrolocarbazoles CEPHALON, INC. (US) 2001-04-04 EP disclosed
US-5591855-A KINASE INHIBITORS, TROPHIC FACTOR-INDUCED ACTIVITY ENHANCEMENT, CELL SURVIVAL CEPHALON, INC. (US) 1997-01-07 US disclosed