SCHEMBL23086154

SCHEMBL23086154

O=C(Nc1ccc(Cl)cc1-c1nnn[nH]1)c1cccc(-c2ccc3ncccc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 7/20 0.52
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ HTT P42858 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43
▸ SIRT2 Q8IXJ6 5/20 0.43
▸ PABPC1 P11940 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ BRAF P15056 1/20 0.40

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
SCHEMBL417135 0.87 SERPINE1 (0.66) SERPINE1NPC1RAB9AMEN1KMT2A
SCHEMBL420345 0.81 SERPINE1 (0.69) SERPINE1NPC1RAB9AHTTMEN1
SCHEMBL418849 0.81 SERPINE1 (0.67) SERPINE1NPC1RAB9AHTTMEN1
SCHEMBL418848 0.80 SERPINE1 (0.79) SERPINE1NPC1RAB9AHTTMEN1
SCHEMBL417156 0.79 SERPINE1 (0.61) SERPINE1NPC1RAB9AHTTMEN1
SCHEMBL6710125 0.75 SERPINE1 (0.48) SERPINE1NPC1RAB9AMEN1KMT2A
SCHEMBL6713754 0.74 SERPINE1 (0.43) SERPINE1L3MBTL1
SCHEMBL1307945 0.74 GPR35 (0.58) SERPINE1NPC1RAB9AMEN1KMT2A
SCHEMBL6713933 0.73 RXFP1 (0.41) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL19554341 0.73 HDAC3 (0.45) SERPINE1NPC1RAB9A

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-2607348-B1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE INC (JP) 2021-03-17 — — EP claimed
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