SCHEMBL11044932

SCHEMBL11044932

[CH2]C(C)Cc1ccccc1CC([CH2])C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
TAAR1 Q96RJ0 5/20 0.37
SIGMAR1 Q99720 4/20 0.37
SLC6A2 P23975 3/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
MAOA P21397 1/20 0.37
CYP2A6 P11509 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
SLC18A2 Q05940 1/20 0.34
CYP2D6 P10635 1/20 0.34
LMNA P02545 1/20 0.33
TRPA1 O75762 1/20 0.33
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL6084229 0.84 SLC6A2 (0.50) TAAR1SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL6651584 0.84 IDO1 (0.47) TAAR1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL9026107 0.84 HSPA5 (0.50) GABRA1GABRB2TAAR1SLC6A2SLC6A4
SCHEMBL4817621 0.80 CYP1A2 (0.50) SIGMAR1SLC6A4SLC18A2CYP2D6
SCHEMBL9026783 0.79 SIGMAR1 (0.49) SIGMAR1
SCHEMBL840750 0.77 GABRA1 (0.64) GABRA1GABRB2TAAR1SIGMAR1SLC6A2
SCHEMBL1665924 0.76 ALDH1A1 (0.55) POLB
SCHEMBL58784 0.76 SIGMAR1 (0.58) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL5174943 0.74 GABRA1 (0.61) GABRA1GABRB2TAAR1SIGMAR1SLC6A2
SCHEMBL5174936 0.74 GABRA1 (0.61) GABRA1GABRB2TAAR1SIGMAR1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4438278-A CROSSLINKABLE MONOMERS EASTMAN KODAK COMPANY (US) 1984-03-20 US disclosed
US-4421915-A Polymerizable ethylenically unsaturated amide compounds EASTMAN KODAK COMPANY (US) 1983-12-20 US disclosed
EP-0013147-B1 POLYMERISABLE MONOMERS, THEIR USE TO PREPARE CROSS-LINKABLE POLYMERS AND THE CROSS-LINKABLE POLYMERS EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1983-10-26 EP disclosed
US-4346231-A Polymerizable ethylenically unsaturated amide compounds PONTICELLO IGNAZIO S 1982-08-24 US disclosed
US-4247673-A COLOR COUPLERS, PHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1981-01-27 US disclosed
US-4215195-A CROSSLINKABLE, POLYMERIC COLOR COUPLERS, GELATIN EXTENDERS, BINDERS EASTMAN KODAK COMPANY (US) 1980-07-29 US disclosed
EP-0013147-A2 POLYMERISABLE MONOMERS, THEIR USE TO PREPARE CROSS-LINKABLE POLYMERS AND THE CROSS-LINKABLE POLYMERS EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1980-07-09 EP disclosed