SCHEMBL20725724

SCHEMBL20725724

C=C(C)Nc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.52
▸ NPC1 O15118 3/20 0.52
▸ HTT P42858 3/20 0.52
▸ RAB9A P51151 3/20 0.52
▸ MAPT P10636 3/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ GAA P10253 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ NLRP1 Q9C000 1/20 0.52
▸ EPHX1 P07099 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ CNR1 P21554 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ PKM P14618 1/20 0.44
▸ NOX1 Q9Y5S8 1/20 0.44

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
SCHEMBL19825999 0.87 SMN1; SMN2 (0.46) ALDH1A1NPC1HTTRAB9AMAPT
SCHEMBL8544515 0.79 RXFP1 (0.62) ALDH1A1NPC1HTTRAB9AMAPT
SCHEMBL10057892 0.78 TDP1 (0.60) ALDH1A1NPC1HTTRAB9AMAPT
SCHEMBL12209638 0.78 MAPT (0.60) ALDH1A1NPC1HTTRAB9AMAPT
SCHEMBL8297116 0.77 ALDH1A1 (0.48) ALDH1A1NPC1HTTRAB9AMAPT
SCHEMBL12190501 0.77 KIF11 (0.52) ALDH1A1NPC1HTTRAB9ASMN1; SMN2
SCHEMBL14768879 0.77 ALDH1A1 (0.59) ALDH1A1NPC1HTTRAB9AMAPT
SCHEMBL13460760 0.76 IDO1 (0.47) ALDH1A1HTTMAPTSMN1; SMN2MEN1
SCHEMBL13424786 0.76 MEN1 (0.52) ALDH1A1NPC1HTTRAB9AMAPT
SCHEMBL22384713 0.76 NPC1 (0.43) ALDH1A1NPC1HTTRAB9AMAPT

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-2707101-B1 PROTEOSTASIS REGULATORS PROTEOSTASIS THERAPEUTICS INC (US) 2019-02-13 — — EP disclosed
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