SCHEMBL14214536

SCHEMBL14214536

O=c1[nH]c2ccccc2n1-c1ncnc(Nc2ccc(F)c(Cl)c2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
PTK6 Q13882 1/20 0.49
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
EGFR P00533 4/20 0.43
SCN9A Q15858 4/20 0.43
KDR P35968 2/20 0.41
GRM4 Q14833 1/20 0.41
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40
GABRE P78334 2/20 0.40

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
SCHEMBL14214546 0.81 PIK3CA (0.48) KDRGABRPGABRDGABRA1GABRB1
SCHEMBL14214540 0.81 GSK3B (0.43) RAB9AEGFRKDRGABRPGABRD
SCHEMBL14214630 0.81 LCK (0.51) PTK6SCN9AKDRGABRPGABRD
SCHEMBL14214537 0.81 PIK3CA (0.61) PTK6EGFRKDRPIK3CAMTOR
SCHEMBL14214544 0.81 PIK3CA (0.46) PTK6EGFRSCN9AKDRPIK3CA
SCHEMBL14214545 0.81 AURKA (0.47) EGFRSCN9AKDRGABRPGABRD
SCHEMBL14214629 0.78 GABRP (0.46) KDRGABRPGABRDGABRA1GABRB1
SCHEMBL14214543 0.78 CCNT1 (0.46)
SCHEMBL14214622 0.76 LCK (0.43) EGFRKDRGABRPGABRDGABRA1
SCHEMBL14214608 0.74 GSK3B (0.41) RAB9ANPC1KDRGABRPGABRD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218360-B1 TRIAZINE KINASE INHIBITORS AMGEN INC (US) 2008-05-28 EP disclosed