SCHEMBL18874417

SCHEMBL18874417

COc1ccc(NC2(C(=O)O)Cc3ccccc3C2)cc1SCCc1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.46
▸ LPAR1 Q92633 2/20 0.45
▸ PKM P14618 1/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ MPI P34949 1/20 0.37
▸ NAMPT P43490 1/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ ATM Q13315 1/20 0.36

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
SCHEMBL18874400 0.90 LPAR1 (0.50) POLBLPAR1MEN1KMT2ASMN1; SMN2
SCHEMBL1561331 0.86 LPAR1 (0.58) POLBLPAR1MAPTNAMPTNPC1
SCHEMBL18874178 0.85 LMNA (0.44) POLBLPAR1MEN1KMT2ASMN1; SMN2
SCHEMBL18874335 0.82 POLB (0.45) POLBLPAR1PKMMEN1KMT2A
SCHEMBL1561320 0.76 LPAR1 (0.66) LPAR1NPC1RAB9A
SCHEMBL18874035 0.75 LPAR1 (0.53) POLBLPAR1PKMMEN1KMT2A
SCHEMBL18874043 0.74 LPAR1 (0.48) POLBLPAR1NPC1RAB9A
SCHEMBL18874186 0.73 LPAR1 (0.49) POLBLPAR1NPC1RAB9A
SCHEMBL18874338 0.73 LPAR1 (0.47) POLBLPAR1NPC1RAB9A
SCHEMBL18873947 0.73 LPAR1 (0.47) POLBLPAR1KMT2ANPC1RAB9A

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-2303270-B1 ACYLAMINO-SUBSTITUTED FUSED CYCLOPENTANECARBOXYLIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2017-05-17 — — EP disclosed
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