SCHEMBL698757

SCHEMBL698757

C=C(c1ncc[nH]1)c1ccccc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
CTNNB1 P35222 3/20 0.40
WNT3A P56704 3/20 0.40
CNR2 P34972 2/20 0.39
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
CSNK1A1 P48729 1/20 0.37
TYRO3 Q06418 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
TLK2 Q86UE8 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MTOR P42345 1/20 0.35
ADK P55263 1/20 0.35
NISCH Q9Y2I1 1/20 0.35
SCD O00767 1/20 0.34
KMO O15229 1/20 0.34

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
SCHEMBL697432 0.88 TAAR1 (0.44) KMT2ATAAR1NPC1RAB9A
SCHEMBL697429 0.86 P2RX7 (0.44) KMT2ATAAR1
SCHEMBL11266816 0.78 KMT2A (0.47) KMT2ATAAR1LMNACSNK1A1TYRO3
SCHEMBL697294 0.77 KMT2A (0.37) KMT2ATAAR1CSNK1A1TYRO3DYRK1B
SCHEMBL697291 0.76 KMT2A (0.46) KMT2ATAAR1CTNNB1WNT3ACSNK1A1
SCHEMBL697904 0.75 KMT2A (0.42) KMT2ACSNK1A1TYRO3DYRK1BNPC1
SCHEMBL697349 0.72 KMT2A (0.54) KMT2ATAAR1CNR2NPC1RAB9A
SCHEMBL703336 0.72 NPC1 (0.44) CNR2TLK2NPC1RAB9A
SCHEMBL11137294 0.72 NPC1 (0.42) KMT2ACSNK1A1TYRO3DYRK1BNPC1
SCHEMBL697784 0.72 MTOR (0.47) KMT2ATAAR1GAACSNK1A1TYRO3

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