SCHEMBL7782268

SCHEMBL7782268

N#CC(=C1CCCCN1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
HPGD P15428 1/20 0.62
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
MAPT P10636 3/20 0.57
MAPK1 P28482 3/20 0.57
TSHR P16473 2/20 0.57
ALDH1A1 P00352 7/20 0.56
GAA P10253 1/20 0.56
CASP1 P29466 1/20 0.52
HSD17B10 Q99714 2/20 0.51
HCRTR1 O43613 1/20 0.51
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.40
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL11472131 0.98 NPC1 (0.65) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL11472132 0.98 NPC1 (0.65) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL11384060 0.86 MEN1 (0.57) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL11379799 0.86 MEN1 (0.57) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL7778947 0.84 ALDH1A1 (0.48) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL7782342 0.84 NPC1 (0.47) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL11485620 0.83 RAB9A (0.49) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL11485616 0.83 RAB9A (0.49) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL11480601 0.81 NPC1 (0.50) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL11480596 0.81 NPC1 (0.50) NPC1RAB9ASMN1; SMN2HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0949247-B1 Process for the preparation of piperidinylidene derivatives TAKASAGO PERFUMERY CO LTD (JP) 2001-09-12 EP claimed
US-6008358-A Process for the preparation of piperidinylidene derivative TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-12-28 US claimed
EP-0949247-A1 Process for the preparation of piperidinylidene derivatives Takasago International Corporation (JP) 1999-10-13 EP claimed
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
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
EP-0949247-A1 Process for the preparation of piperidinylidene derivatives Takasago International Corporation (JP) 1999-10-13 EP disclosed