SCHEMBL14742811

SCHEMBL14742811

CC(C)C(C)CCCNC(=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.59
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
EPHX2 P34913 2/20 0.57
HDAC3 O15379 3/20 0.55
HDAC4 P56524 3/20 0.55
HDAC1 Q13547 3/20 0.55
HDAC7 Q8WUI4 3/20 0.55
HDAC2 Q92769 3/20 0.55
HDAC10 Q969S8 3/20 0.55
HDAC11 Q96DB2 3/20 0.55
HDAC8 Q9BY41 3/20 0.55
HDAC6 Q9UBN7 3/20 0.55
HDAC9 Q9UKV0 3/20 0.55
HDAC5 Q9UQL6 3/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.54
GAA P10253 1/20 0.50
PAX8 Q06710 1/20 0.50

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
SCHEMBL10137831 0.87 SMN1; SMN2 (0.67) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL27512265 0.85 NAAA (0.61) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL7099696 0.84 NAAA (0.59) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL23996124 0.84 HDAC3 (0.59) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL14144651 0.84 NAAA (0.59) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL6579629 0.83 NAAA (0.58) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL12650598 0.82 NAAA (0.66) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL20362840 0.81 RAB9A (0.64) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL10099547 0.81 NAAA (0.69) NAAANPC1RAB9AEPHX2HDAC3
SCHEMBL8779817 0.80 HDAC1 (0.79) NAAANPC1RAB9AEPHX2HDAC3

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
EP-3356356-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 Senomyx, Inc. (US) 2018-08-08 EP disclosed
EP-2763554-A1 NOVEL SUBSTITUTED CYCLOHEXANE COMPOUNDS Takasago International Corporation (USA) (US) 2014-08-13 EP disclosed
CN-103796535-A Novel substituted cyclohexane compounds TAKASAGO INTERNAT CORP USA 2014-05-14 CN disclosed
WO-2013033501-A1 NOVEL SUBSTITUTED CYCLOHEXANE COMPOUNDS TAKASAGO INTERNATIONAL CORP. (USA) (US) 2013-03-07 WO disclosed