SCHEMBL5345269

SCHEMBL5345269

COc1cc(Cn2ccc3cccnc32)c(F)cc1OCc1ccncc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 7/20 0.39
NTRK1 P04629 2/20 0.39
NTRK2 Q16620 2/20 0.39
PDE10A Q9Y233 1/20 0.38
FLT1 P17948 1/20 0.38
KDR P35968 1/20 0.38
PTK2 Q05397 2/20 0.37
SLC22A12 Q96S37 2/20 0.36
PLK1 P53350 1/20 0.36
ABCB1 P08183 1/20 0.36
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL5328756 0.82 MAPK14 (0.39) KDM4EMEN1NPC1RAB9AKMT2A
SCHEMBL5322845 0.76 CSF1R (0.55) CSF1RKDM4EALDH1A1LMNATSHR
SCHEMBL411641 0.70 FGFR1 (0.51) CSF1RFLT1KDRPLK1NPSR1
SCHEMBL1362776 0.68 MTNR1A (0.44) PTK2SLC22A12
SCHEMBL28251110 0.67 LMNA (0.47) CSF1RKDM4ELMNANPC1RAB9A
SCHEMBL3537897 0.67 LPO (0.55) KDM4EUSP2ALDH1A1LMNATSHR
SCHEMBL9278020 0.65 TP53 (0.45) KDM4EALDH1A1LMNAMEN1NPC1
SCHEMBL414642 0.65 CTSV (0.39) CSF1RFLT1KDRKDM4EALDH1A1
SCHEMBL5345274 0.65 KDR (0.42) CSF1RPDE10AFLT1KDRPLK1
SCHEMBL38652180 0.65 KDM4E (0.56) KDM4EALDH1A1HSD17B10MEN1NPC1

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
WO-2007002325-A1 PYRROLO[2,3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 WO disclosed