SCHEMBL28045872

SCHEMBL28045872

O=C(NCc1ccccc1)OC[C@@H](O)Cc1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.44
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TXNRD1 Q16881 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL28321127 0.81 ADRB2 (0.44) RAB9ANPC1SMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL29220573 0.79 PLAU (0.47) L3MBTL1ALDH1A1
SCHEMBL27535453 0.78 PLAU (0.46) L3MBTL1ALDH1A1
SCHEMBL27535455 0.78 PLAU (0.46) L3MBTL1ALDH1A1
SCHEMBL17053673 0.76 L3MBTL1 (0.46) L3MBTL1
SCHEMBL28018053 0.75 MAPT (0.54) RAB9ANPC1L3MBTL1ALDH1A1
SCHEMBL16796659 0.74 CA1 (0.57) RAB9ASMN1; SMN2ALDH1A1
SCHEMBL18802269 0.74 CA1 (0.57) RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17045233 0.74 MMP2 (0.51) L3MBTL1
SCHEMBL17045235 0.74 MMP2 (0.51) L3MBTL1

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
CN-105188690-A Phenyl carbamate compounds for use in preventing or treating a movement disorder BIO PHARM SOLUTIONS CO LTD 2015-12-23 CN claimed
CN-105189450-A Phenyl carbamate compound and composition for preventing or treating mental disorder comprising the same BIO PHARM SOLUTIONS CO LTD 2015-12-23 CN claimed
CN-105188690-A Phenyl carbamate compounds for use in preventing or treating a movement disorder BIO PHARM SOLUTIONS CO LTD 2015-12-23 CN disclosed
CN-105189450-A Phenyl carbamate compound and composition for preventing or treating mental disorder comprising the same BIO PHARM SOLUTIONS CO LTD 2015-12-23 CN disclosed