SCHEMBL16812352

SCHEMBL16812352

CNC(=O)c1cnc2c(N(C)Cc3ccc(OC)cc3)cc(Cl)nn12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE1B Q01064 4/20 0.38
▸ NR3C1 P04150 4/20 0.38
▸ MALT1 Q9UDY8 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ MAPK8 P45983 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ ACLY P53396 1/20 0.35
▸ KDM1A O60341 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC2 Q92769 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
SCHEMBL16812355 0.91 ALDH1A1 (0.39) PDE1BNR3C1MEN1KMT2AALDH1A1
SCHEMBL16812493 0.91 NR3C1 (0.39) PDE1BNR3C1MEN1KMT2AALDH1A1
SCHEMBL16794702 0.89 NR3C1 (0.35) PDE1BNR3C1MEN1KMT2AALDH1A1
SCHEMBL18161034 0.89 PDE1B (0.41) PDE1BNR3C1MEN1KMT2AALDH1A1
SCHEMBL16794676 0.89 PDE1B (0.40) PDE1BNR3C1MEN1KMT2AALDH1A1
SCHEMBL24263381 0.88 PDE1B (0.39) PDE1BNR3C1MEN1KMT2AALDH1A1
SCHEMBL16794653 0.88 CNR2 (0.41) ALDH1A1POLB
SCHEMBL16812354 0.88 CDK5 (0.39) PDE1BNR3C1MEN1KMT2ASMN1; SMN2
SCHEMBL16812482 0.88 NPC1 (0.40) PDE1BNR3C1MEN1KMT2AALDH1A1
SCHEMBL16812486 0.88 NPC1 (0.40) PDE1BNR3C1MEN1KMT2AALDH1A1

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
WO-2015089143-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL-MYERS SQUIBB COMPANY (US) 2015-06-18 — — WO disclosed
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