SCHEMBL697561

SCHEMBL697561

C=C(c1ncc[nH]1)c1ccc(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
MEN1 O00255 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TSHR P16473 1/20 0.40
CASP1 P29466 1/20 0.40
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
HPGD P15428 3/20 0.37
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALPL P05186 1/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL705111 0.88 KMT2A (0.48) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL11304735 0.82 KMT2A (0.47) KMT2ARAB9ANPC1MEN1SMN1; SMN2
SCHEMBL1573101 0.81 TYK2 (0.43) KMT2ARAB9ANPC1MEN1LMNA
SCHEMBL11267970 0.80 AKR1C4 (0.41) KMT2ARAB9ANPC1MEN1SMN1; SMN2
SCHEMBL11141785 0.79 KMT2A (0.46) KMT2ARAB9ANPC1MEN1SMN1; SMN2
SCHEMBL6087751 0.76 FABP3 (0.48) KMT2AMEN1SMN1; SMN2TSHRLMNA
SCHEMBL698190 0.76 KMT2A (0.52) KMT2ARAB9ANPC1MEN1SMN1; SMN2
SCHEMBL702086 0.76 KMT2A (0.46) KMT2ARAB9ANPC1MEN1SMN1; SMN2
SCHEMBL696873 0.75 KMT2A (0.55) KMT2ARAB9ANPC1SMN1; SMN2TSHR
SCHEMBL696226 0.75 KMT2A (0.41) KMT2ARAB9ANPC1MEN1USP2

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
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed
EP-0048827-A1 Substituted 2,4-dichlorophenyl-imidazolyl-vinyl ketones, processes for their preparation and antimicrobial agents containing these compounds BAYER AG (DE) 1982-04-07 EP disclosed