SCHEMBL697082

SCHEMBL697082

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 1/20 0.38
KMT2A Q03164 3/20 0.38
ADRA2A P08913 2/20 0.37
ADRA1A P35348 2/20 0.37
ADRA2C P18825 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1B P35368 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ABL1 P00519 1/20 0.34
RAD52 P43351 1/20 0.34
RIN1 Q13671 1/20 0.34
MC4R P32245 2/20 0.33
EED O75530 1/20 0.33
RBBP4 Q09028 1/20 0.33
SUZ12 Q15022 1/20 0.33
EZH2 Q15910 1/20 0.33
AEBP2 Q6ZN18 1/20 0.33
MEN1 O00255 2/20 0.33
HCRTR1 O43613 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
SCHEMBL697619 0.82 KMT2A (0.41) KMT2ANPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL698190 0.80 KMT2A (0.52) KMT2AADRA2AADRA1AADRA2CADRA1D
SCHEMBL703857 0.80 KMT2A (0.39) KMT2ANPC1RAB9AMC4RALDH1A1
SCHEMBL697273 0.78 KMT2A (0.50) SMPD3KMT2AADRA2AADRA1AADRA2C
SCHEMBL697771 0.76 SMPD3 (0.42) SMPD3KMT2AADRA2AADRA1AADRA2C
SCHEMBL698900 0.74 KMT2A (0.46) KMT2AADRA2AADRA1AADRA2CADRA1D
SCHEMBL696517 0.72 TAAR1 (0.47) KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL28007494 0.72 KMT2A (0.54) KMT2ANPC1RAB9AMEN1ALDH1A1
SCHEMBL697904 0.72 KMT2A (0.42) KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL3923733 0.72 MC4R (0.46) SMPD3ADRA2AADRA1AADRA2CADRA1D

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