SCHEMBL9637883

SCHEMBL9637883

NC1CCCCC1NC(=O)Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.62
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 1/20 0.54
GLS O94925 1/20 0.49
MAPT P10636 2/20 0.49
SIGMAR1 Q99720 3/20 0.48
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MMP2 P08253 2/20 0.45
MMP9 P14780 2/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 0.45
MMP8 P22894 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
SCHEMBL6385132 0.83 EPHX2 (0.64) EPHX2MEN1KMT2AALDH1A1GLS
SCHEMBL11087924 0.83 EPHX2 (0.64) EPHX2MEN1KMT2AALDH1A1GLS
SCHEMBL11079215 0.81 EPHX2 (0.62) EPHX2MEN1KMT2AALDH1A1GLS
SCHEMBL11079169 0.81 EPHX2 (0.67) EPHX2MEN1KMT2AALDH1A1GLS
SCHEMBL7848641 0.81 LMNA (0.46) EPHX2MEN1KMT2AALDH1A1MAPT
SCHEMBL11077879 0.80 EPHX2 (0.65) EPHX2MEN1KMT2AALDH1A1GLS
SCHEMBL28857728 0.80 ALDH1A1 (0.59) MEN1KMT2AALDH1A1
SCHEMBL1008551 0.80 ALDH1A1 (0.59) MEN1KMT2AALDH1A1
SCHEMBL11083024 0.79 EPHX2 (0.59) EPHX2MEN1KMT2AALDH1A1GLS
SCHEMBL14472842 0.79 EPHX1 (0.67) EPHX2MEN1KMT2AALDH1A1MAPT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5109008-A Analgesics, diuretics, antiischemic agents GLAXO GROUP LIMITED (GB) 1992-04-28 US disclosed
EP-0366327-A1 Furo- and thieno[3,2-c]pyridines and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1990-05-02 EP disclosed
EP-0176309-A3 USE OF N-(2-AMINOCYCLOHEXYL)BENZENEACETAMIDES IN THE TREATMENT OF CEREBRAL ISCHEMIA THE UPJOHN COMPANY (US) 1987-11-25 EP disclosed
EP-0176309-A3 USE OF N-(2-AMINOCYCLOHEXYL)BENZENEACETAMIDES IN THE TREATMENT OF CEREBRAL ISCHEMIA THE UPJOHN COMPANY (US) 1987-11-25 EP disclosed
US-4618621-A SUBSTITUTED CYCLOHEXYLBENZENEACETAMIDE THE UPJOHN COMPANY (US) 1986-10-21 US disclosed
US-4588591-A Analgesic 2-oxa-spirocyclic compounds THE UPJOHN COMPANY (US) 1986-05-13 US disclosed
EP-0176309-A2 Use of N-(2-aminocyclohexyl)benzeneacetamides in the treatment of cerebral ischemia THE UPJOHN COMPANY (US) 1986-04-02 EP disclosed
EP-0176309-A2 Use of N-(2-aminocyclohexyl)benzeneacetamides in the treatment of cerebral ischemia THE UPJOHN COMPANY (US) 1986-04-02 EP disclosed
EP-0176309-A2 Use of N-(2-aminocyclohexyl)benzeneacetamides in the treatment of cerebral ischemia THE UPJOHN COMPANY (US) 1986-04-02 EP disclosed
US-4463013-A Oxygen substituted amino-cyclohexyl-benzeneacetamides and -benzamides as water diuretic drugs THE UPJOHN COMPANY (US) 1984-07-31 US disclosed