SCHEMBL7541114

SCHEMBL7541114

COC(=O)C(=C1CCCCN1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 1/20 0.50
HPGD P15428 1/20 0.50
RAB9A P51151 1/20 0.50
MAPT P10636 3/20 0.46
KMT2A Q03164 3/20 0.46
TSHR P16473 3/20 0.46
MEN1 O00255 2/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
CYP3A4 P08684 1/20 0.39
SLC6A3 Q01959 6/20 0.35
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 2/20 0.35
DHFR P00374 1/20 0.35
LMNA P02545 2/20 0.34
F2 P00734 1/20 0.34
SRC P12931 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL15384064 1.00 SMN1; SMN2 (0.50) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL7549282 0.87 RAB9A (0.42) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL7549342 0.86 CA1 (0.42) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL7774549 0.86 RAB9A (0.42) SMN1; SMN2NPC1HPGDRAB9AKMT2A
SCHEMBL7540214 0.85 SMN1; SMN2 (0.47) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL7547525 0.85 NPC1 (0.47) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL1144315 0.83 RAB9A (0.56) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL7543674 0.80 RAB9A (0.54) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL11374162 0.75 TSHR (0.57) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL5764963 0.72 NPC1 (0.54) SMN1; SMN2NPC1HPGDRAB9AMAPT

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
JP-10279559-A None JP disclosed
EP-0860432-B1 2-Phenyl-2-(2'-piperidinylidene) acetate derivative, process for manufacturing the same, and process for manufacturing optically active 2-phenyl-2(2'-piperidinyl) acetate derivative by asymmetrically hydrogenating the same TAKASAGO PERFUMERY CO LTD (JP) 2002-06-05 EP disclosed
EP-0949247-B1 Process for the preparation of piperidinylidene derivatives TAKASAGO PERFUMERY CO LTD (JP) 2001-09-12 EP disclosed
US-6008358-A Process for the preparation of piperidinylidene derivative TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-12-28 US disclosed
EP-0949247-A1 Process for the preparation of piperidinylidene derivatives Takasago International Corporation (JP) 1999-10-13 EP disclosed
US-5859249-A CYCLIZATION A 7-(N-SUBSTITUTED AMINO)-3-OXO-2-PHENYLHEPTANOATE TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-01-12 US disclosed
JP-H10279559-A 2-PHENYL-2-(2'-PIPERIDINYLIDENE)ACETIC ACID ESTER DERIVATIVE AND ITS PRODUCTION TAKASAGO INTERNATL CORP 1998-10-20 JP disclosed
US-5801271-A CHEMICAL INTERMEDIATES FOR ANTIDEPRESSANTS TAKASAGO INTERNATIONAL CORPORATION (JP) 1998-09-01 US disclosed
EP-0860432-A1 2-Phenyl-2-(2'-piperidinylidene) acetate derivative, process for manufacturing the same, and process for manufacturing optically active 2-phenyl-2(2'-piperidinyl) acetate derivative by asymmetrically hydrogenating the same Takasago International Corporation (JP) 1998-08-26 EP disclosed
EP-0860426-A1 7-(n-substituted amino)-2-phenylheptanoic acid derivative and process for manufacturing the same Takasago International Corporation (JP) 1998-08-26 EP disclosed