SCHEMBL2953487

SCHEMBL2953487

Cc1cc(NC(=O)c2ccc(C)c(-c3ccc4c(N5CCOCC5)nncc4c3)c2)no1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.72
KIT P10721 6/20 0.72
KDR P35968 5/20 0.72
MAPK9 P45984 4/20 0.72
LCK P06239 4/20 0.72
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPK10 P53779 1/20 0.46
MAP2K1 Q02750 1/20 0.45
MAPK13 O15264 1/20 0.44
RAF1 P04049 1/20 0.44
BRAF P15056 1/20 0.44

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
SCHEMBL2947717 0.89 MAPK14 (0.71) MAPK14KITKDRMAPK9LCK
SCHEMBL2944127 0.87 MAPK14 (0.80) MAPK14KITKDRMAPK9LCK
SCHEMBL2954491 0.84 MAPK14 (0.77) MAPK14KITKDRMAPK9LCK
SCHEMBL2948571 0.84 MAPK14 (0.77) MAPK14KITKDRMAPK9LCK
SCHEMBL2954517 0.84 MAPK14 (0.77) MAPK14KITKDRMAPK9LCK
SCHEMBL2945892 0.84 MAPK14 (0.78) MAPK14KITKDRMAPK9LCK
SCHEMBL2945618 0.84 MAPK14 (1.00) MAPK14KITKDRMAPK9LCK
SCHEMBL2952099 0.83 MAPK14 (0.74) MAPK14KITKDRMAPK9LCK
SCHEMBL2956864 0.82 MAPK14 (0.95) MAPK14KITKDRMAPK9LCK
SCHEMBL2954539 0.82 MAPK14 (0.72) MAPK14KITKDRMAPK9LCK

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-1856058-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2014-09-03 EP claimed
US-7759337-B2 Phthalazine compounds and methods of use AMGEN INC. (US) 2010-07-20 US claimed
EP-1856058-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-11-21 EP claimed
WO-2006094187-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2006-09-08 WO claimed
EP-1856058-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2014-09-03 EP disclosed