SCHEMBL16794702

SCHEMBL16794702

COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC4=CC=C4)cnc23)cc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 10/20 0.35
▸ PDE1B Q01064 3/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CACNA1G O43497 1/20 0.33
▸ CACNA1H O95180 1/20 0.33
▸ CACNA1I Q9P0X4 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC10 Q969S8 1/20 0.33
▸ NCOR2 Q9Y618 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
SCHEMBL16812352 0.89 PDE1B (0.38) NR3C1PDE1BMEN1KMT2ASMN1; SMN2
SCHEMBL16812493 0.86 NR3C1 (0.39) NR3C1PDE1BMEN1KMT2ASMN1; SMN2
SCHEMBL16812355 0.86 ALDH1A1 (0.39) NR3C1PDE1BMEN1KMT2ASMN1; SMN2
SCHEMBL18161034 0.84 PDE1B (0.41) NR3C1PDE1BMEN1KMT2ASMN1; SMN2
SCHEMBL16794676 0.84 PDE1B (0.40) NR3C1PDE1BMEN1KMT2ASMN1; SMN2
SCHEMBL24263381 0.84 PDE1B (0.39) NR3C1PDE1BMEN1KMT2ASMN1; SMN2
SCHEMBL16794653 0.83 CNR2 (0.41) ALDH1A1
SCHEMBL16812486 0.83 NPC1 (0.40) NR3C1PDE1BMEN1KMT2ASMN1; SMN2
SCHEMBL16812354 0.83 CDK5 (0.39) NR3C1PDE1BMEN1KMT2ASMN1; SMN2
SCHEMBL16812482 0.83 NPC1 (0.40) NR3C1PDE1BMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541817-A1 IMIDAZOPYRIDAZINE MODULATORS OF IL-12, IL-23 AND/OR IFN-ALPHA Bristol-Myers Squibb Company (US) 2019-09-25 — — EP disclosed
WO-2018093968-A1 IMIDAZOPYRIDAZINE MODULATORS OF IL-12, IL-23 AND/OR IFN-ALPHA BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-24 — — WO disclosed
EP-3080131-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES Bristol-Myers Squibb Company (US) 2016-10-19 — — EP disclosed
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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