SCHEMBL7220972

SCHEMBL7220972

Cc1n[c]nn1-c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
NOTUM Q6P988 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
PTGS2 P35354 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 3/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GRM1 Q13255 2/20 0.39
HSD17B10 Q99714 1/20 0.39
BRD4 O60885 1/20 0.36
GRM5 P41594 1/20 0.35
OPRM1 P35372 1/20 0.35

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
SCHEMBL20320623 0.68 KMT2A (0.53) POLBNOTUMNPC1RAB9APTGS2
SCHEMBL17206057 0.68 POLB (0.44) POLBNOTUMNPC1RAB9APTGS2
SCHEMBL23421466 0.68 CNR1 (0.40) PTGS2KMT2ALMNAALDH1A1MEN1
SCHEMBL2347651 0.67 NPC1 (0.42) POLBNOTUMNPC1RAB9APTGS2
SCHEMBL10360347 0.65 KMT2A (0.54) POLBNOTUMNPC1RAB9APTGS2
SCHEMBL19453172 0.65 OXTR (0.48) POLBNOTUMNPC1RAB9APTGS2
SCHEMBL11635129 0.64 NOTUM (0.45) POLBNOTUMNPC1RAB9APTGS2
SCHEMBL12770967 0.64 POLB (0.64) POLBNPC1RAB9ASMN1; SMN2GAA
SCHEMBL12770975 0.64 POLB (0.65) POLBNOTUMNPC1RAB9APTGS2
SCHEMBL10091953 0.64 NOTUM (0.62) POLBNOTUMNPC1RAB9APTGS2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605631-B1 Controlling fungi and pests; improved activity and plant tolerability BASF AKTIENGESELLSCHAFT (DE) 2003-08-12 US disclosed