SCHEMBL5494632

SCHEMBL5494632

CCc1ccc(C#Cc2cc[c]cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.56
ACACB O00763 1/20 0.44
TP53 P04637 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36
LPL P06858 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
FFAR1 O14842 3/20 0.35
ALDH1A1 P00352 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
CA2 P00918 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33

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
SCHEMBL5050178 0.86 CYP2A6 (0.64) CYP2A6ACACBTP53TAAR1EGLN1
SCHEMBL8228398 0.86 CYP2A6 (0.64) CYP2A6ACACBTP53TAAR1EGLN1
SCHEMBL9509240 0.79 CYP2A6 (0.56) CYP2A6ACACBTP53TAAR1EGLN1
SCHEMBL2014107 0.79 TSHR (0.47) ACACBLPLLIPGFFAR1ALDH1A1
SCHEMBL8988354 0.78 TRPA1 (0.37) CYP2A6FFAR1ALDH1A1HRH3LOXL2
SCHEMBL240859 0.78 IDO1 (0.39) CYP2A6FFAR1LOXL2
SCHEMBL242962 0.78 FFAR1 (0.34) CYP2A6FFAR1LOXL2
SCHEMBL242388 0.78 FFAR1 (0.39) EGLN1FFAR1CA2TSHR
SCHEMBL21510 0.78
Water SCHEMBL28104109 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7303856-B2 Light-sensitive sheet comprising support, first light-sensitive layer and second light-sensitive layer FUJIFILM CORPORATION (JP) 2007-12-04 US disclosed
US-7150955-B2 Light-sensitive sheet comprising support, first and second light-sensitive layers and barrier layer FUJI PHOTO FILM CO., LTD. (JP) 2006-12-19 US disclosed
US-20050037281-A1 Light-sensitive sheet comprising support, first and second light-sensitive layers and barrier layer FUJI PHOTO FILM CO., LTD. 2005-02-17 US disclosed
EP-1507171-A2 Light-Sensitive sheet comprising support, first and second light-sensitive layers and barrier layer FUJI PHOTO FILM CO., LTD. (JP) 2005-02-16 EP disclosed
US-20050025946-A1 Light-sensitive sheet comprising support, first light-sensitive layer and second light-sensitive layer FUJI PHOTO FILM CO., LTD. 2005-02-03 US disclosed
EP-1489460-A2 Light-sensitive sheet comprising support, first light-sensitive layer and second light-sensitive layer Fuji Photo Film Co., Ltd. (JP) 2004-12-22 EP disclosed