SCHEMBL697294

SCHEMBL697294

C=C(c1ncc[nH]1)c1cccc(C)c1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.37
TAAR1 Q96RJ0 2/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
F2RL1 P55085 1/20 0.35
GLA P06280 1/20 0.32
CSNK1A1 P48729 1/20 0.31
TYRO3 Q06418 1/20 0.31
DYRK1B Q9Y463 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NISCH Q9Y2I1 1/20 0.30
P2RX7 Q99572 1/20 0.30

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
SCHEMBL697619 0.81 KMT2A (0.41) KMT2ATAAR1NPC1RAB9AF2RL1
SCHEMBL697291 0.81 KMT2A (0.46) KMT2ATAAR1NPC1RAB9AGLA
SCHEMBL698900 0.79 KMT2A (0.46) KMT2ATAAR1NPC1RAB9AF2RL1
SCHEMBL697432 0.78 TAAR1 (0.44) KMT2ATAAR1NPC1RAB9AP2RX7
SCHEMBL698757 0.77 KMT2A (0.43) KMT2ATAAR1NPC1RAB9ACSNK1A1
SCHEMBL696517 0.77 TAAR1 (0.47) KMT2ATAAR1NPC1RAB9AF2RL1
SCHEMBL698561 0.76 TAAR1 (0.44) KMT2ATAAR1NPC1RAB9AF2RL1
SCHEMBL703857 0.76 KMT2A (0.39) KMT2ATAAR1NPC1RAB9AF2RL1
SCHEMBL697429 0.76 P2RX7 (0.44) KMT2ATAAR1P2RX7
SCHEMBL697904 0.74 KMT2A (0.42) KMT2ANPC1RAB9AF2RL1GLA

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-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed