SCHEMBL698190

SCHEMBL698190

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
ADRA2A P08913 2/20 0.40
ADRA1A P35348 2/20 0.40
ADRA2C P18825 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1B P35368 1/20 0.40
TAAR1 Q96RJ0 2/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
F2RL1 P55085 3/20 0.38
DHODH Q02127 1/20 0.36
GLA P06280 1/20 0.36
P2RX7 Q99572 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDE10A Q9Y233 1/20 0.33
CSNK1A1 P48729 1/20 0.33
TYRO3 Q06418 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL696873 0.85 KMT2A (0.55) KMT2AADRA2AADRA1AADRA2CADRA1D
SCHEMBL697619 0.85 KMT2A (0.41) KMT2ATAAR1NPC1RAB9AF2RL1
SCHEMBL697273 0.83 KMT2A (0.50) KMT2AADRA2AADRA1AADRA2CADRA1D
SCHEMBL703857 0.82 KMT2A (0.39) KMT2ATAAR1NPC1RAB9AF2RL1
SCHEMBL698900 0.82 KMT2A (0.46) KMT2AADRA2AADRA1AADRA2CADRA1D
SCHEMBL697082 0.80 SMPD3 (0.38) KMT2AADRA2AADRA1AADRA2CADRA1D
SCHEMBL697291 0.78 KMT2A (0.46) KMT2ATAAR1NPC1RAB9AGLA
SCHEMBL702086 0.77 KMT2A (0.46) KMT2AADRA2AADRA1AADRA2CADRA1D
SCHEMBL697561 0.76 KMT2A (0.44) KMT2ANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL696517 0.74 TAAR1 (0.47) KMT2ATAAR1NPC1RAB9AF2RL1

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 3 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
CN-101370786-B Substituted imidazoles and their use as pesticides PFIZER 2012-01-11 CN disclosed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed