SCHEMBL6628580

SCHEMBL6628580

COc1ccc2c(c1)-c1c3c(c4c([nH]c5ccccc54)c1C2)C(=O)NC3

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K9 P80192 6/20 0.72
MAP3K11 Q16584 6/20 0.72
MAP3K10 Q02779 3/20 0.72
NTRK1 P04629 2/20 0.72
KDR P35968 2/20 0.72
PRKCA P17252 5/20 0.60
PRKCQ Q04759 4/20 0.60
PRKCD Q05655 4/20 0.60
PRKD3 O94806 3/20 0.60
PRKCG P05129 3/20 0.60
PRKCB P05771 3/20 0.60
PRKCH P24723 3/20 0.60
PRKCI P41743 3/20 0.60
PRKCE Q02156 3/20 0.60
PRKCZ Q05513 3/20 0.60
PRKD1 Q15139 3/20 0.60
CDK4 P11802 2/20 0.55
CCND1 P24385 2/20 0.55
CAMK2B Q13554 2/20 0.55
CAMK2G Q13555 2/20 0.55

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
SCHEMBL6628462 0.85 MAP3K9 (0.76) MAP3K9MAP3K11MAP3K10NTRK1KDR
SCHEMBL6630147 0.85 MAP3K9 (0.76) MAP3K9MAP3K11MAP3K10NTRK1KDR
SCHEMBL6629555 0.85 MAP3K9 (0.76) MAP3K9MAP3K11MAP3K10NTRK1KDR
SCHEMBL3082217 0.84 MAP3K9 (1.00) MAP3K9MAP3K11MAP3K10NTRK1KDR
SCHEMBL6629697 0.84 MAP3K9 (0.74) MAP3K9MAP3K11MAP3K10NTRK1KDR
SCHEMBL6632517 0.82 MAP3K9 (0.72) MAP3K9MAP3K11MAP3K10NTRK1KDR
SCHEMBL6627011 0.81 MAP3K9 (0.70) MAP3K9MAP3K11MAP3K10NTRK1KDR
SCHEMBL6627014 0.81 MAP3K9 (0.70) MAP3K9MAP3K11MAP3K10NTRK1KDR
SCHEMBL9263506 0.81 ROCK2 (0.78) MAP3K9MAP3K11PRKCAPRKCQPRKCD
SCHEMBL9260091 0.81 ROCK2 (0.78) MAP3K9MAP3K11PRKCAPRKCQPRKCD

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
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-5705511-A ENZYME INHIBITORS, ANTIINFLAMMATORY, TROPHIC FACTOR, ANTICANCER CELL GROWTH CEPHALON, INC. (US) 1998-01-06 US disclosed
US-5591855-A KINASE INHIBITORS, TROPHIC FACTOR-INDUCED ACTIVITY ENHANCEMENT, CELL SURVIVAL CEPHALON, INC. (US) 1997-01-07 US disclosed