SCHEMBL18985705

SCHEMBL18985705

FC(F)c1cc(-c2ccccc2)ncn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 0.53
MIF P14174 1/20 0.53
KMO O15229 3/20 0.49
NPC1 O15118 3/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 2/20 0.44
TSHR P16473 1/20 0.44
RECQL P46063 1/20 0.44
HRH4 Q9H3N8 1/20 0.41
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
F11 P03951 1/20 0.38
FAAH O00519 1/20 0.38
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL8255870 0.81 ASIC3 (0.53) ASIC3MIFKMONPC1RAB9A
SCHEMBL284286 0.79 ASIC3 (0.71) ASIC3MIFKMONPC1RAB9A
SCHEMBL28218682 0.77 ASIC3 (0.68) ASIC3MIFKMONPC1RAB9A
SCHEMBL27904874 0.77 ASIC3 (0.68) ASIC3MIFKMONPC1RAB9A
SCHEMBL29406194 0.77 ASIC3 (0.68) ASIC3MIFKMONPC1RAB9A
SCHEMBL18985795 0.75 KMT2A (0.42) ASIC3KMOKMT2AKDM4EALDH1A1
SCHEMBL18731738 0.74 ASIC3 (0.65) ASIC3MIFKMONPC1RAB9A
SCHEMBL29730373 0.74 ASIC3 (0.65) ASIC3MIFKMONPC1RAB9A
SCHEMBL17697185 0.74 ASIC3 (0.65) ASIC3MIFKMONPC1RAB9A
SCHEMBL4150983 0.73 ASIC3 (0.49) ASIC3MIFKMONPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3390387-A1 HETEROARYLBENZIMIDAZOLE COMPOUNDS Bayer Pharma Aktiengesellschaft (DE) 2018-10-24 EP disclosed
WO-2017102091-A1 HETEROARYLBENZIMIDAZOLE COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-22 WO disclosed