SCHEMBL11097731

SCHEMBL11097731

CSc1ccc(-c2ccc(-n3ccnc3)cc2)nn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ PKM P14618 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ PDE3B Q13370 2/20 0.50
▸ PDE3A Q14432 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ CASP3 P42574 1/20 0.50
▸ SENP8 Q96LD8 1/20 0.50
▸ SENP7 Q9BQF6 1/20 0.50
▸ SENP6 Q9GZR1 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ MITF O75030 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ LMNA P02545 1/20 0.45
▸ ENPP2 Q13822 1/20 0.45

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
SCHEMBL7299008 0.78 ENPP2 (0.57) NPC1RAB9ASMN1; SMN2MAPTPDE3B
SCHEMBL11099792 0.78 MEN1 (0.54) NPC1RAB9AMAPTPDE3BPDE3A
SCHEMBL11096275 0.77 PDE3B (0.55) MAPTPDE3BPDE3AKMT2AMEN1
SCHEMBL2533488 0.74 TSHR (0.84) NPC1RAB9AMAPTPDE3BPDE3A
SCHEMBL11099214 0.73 KMT2A (0.49) NPC1RAB9ASMN1; SMN2MAPTPDE3B
SCHEMBL5326670 0.73 LMNA (0.58) MAPTKMT2AMEN1ALOX15TSHR
SCHEMBL2532397 0.72 LMNA (0.78) MAPTKMT2AMEN1ALOX15TSHR
Hydrochloric Acid SCHEMBL28701756 0.70 LMNA (0.75) MAPTKMT2AMEN1ALOX15TSHR
SCHEMBL19186987 0.70 KMT2A (0.70) NPC1RAB9ASMN1; SMN2MAPTPDE3B
SCHEMBL1752819 0.69 RAB9A (0.62) NPC1RAB9APKMSMN1; SMN2MAPT

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
EP-0122419-A2 Substituted 3-mercaptopyridazines, their 3-alkylthio derivatives and processes for their preparation A. Nattermann & Cie. GmbH (DE) 1984-10-24 — — EP disclosed
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