SCHEMBL697121

SCHEMBL697121

C=C(c1ncc[nH]1)c1cc(OC)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 2/20 0.43
KMT2A Q03164 2/20 0.43
ADRA2A P08913 1/20 0.40
ADRA2C P18825 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
BRAF P15056 2/20 0.39
HDAC1 Q13547 1/20 0.39
BTK Q06187 1/20 0.36
JAK2 O60674 1/20 0.35
HPGDS O60760 1/20 0.35
SMPD3 Q9NY59 1/20 0.35
TLK2 Q86UE8 2/20 0.34
RAB9A P51151 2/20 0.34
MMP12 P39900 1/20 0.34
NPC1 O15118 1/20 0.34
MEN1 O00255 1/20 0.34
MITF O75030 1/20 0.34
LMNA P02545 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
SCHEMBL1573101 0.89 TYK2 (0.43) TYK2KMT2AADRA2AADRA2CADRA1D
SCHEMBL702086 0.82 KMT2A (0.46) KMT2AADRA2AADRA2CADRA1DADRA1A
SCHEMBL705111 0.81 KMT2A (0.48) TYK2KMT2AJAK2RAB9ANPC1
SCHEMBL697273 0.77 KMT2A (0.50) KMT2AADRA2AADRA2CADRA1DADRA1A
SCHEMBL697991 0.73 CYP1A2 (0.41) KMT2ABRAFHDAC1SMPD3RAB9A
SCHEMBL697561 0.73 KMT2A (0.44) TYK2KMT2AJAK2RAB9ANPC1
SCHEMBL697587 0.71 KMT2A (0.42) KMT2ABRAFHDAC1RAB9ANPC1
SCHEMBL697919 0.70 NPC1 (0.44) KMT2ABRAFHDAC1RAB9ANPC1
SCHEMBL698190 0.70 KMT2A (0.52) KMT2AADRA2AADRA2CADRA1DADRA1A
SCHEMBL696873 0.70 KMT2A (0.55) KMT2AADRA2AADRA2CADRA1DADRA1A

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