SCHEMBL9747206

SCHEMBL9747206

CC(c1ccccc1)C(Cc1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 5/20 0.50
SIGMAR1 Q99720 5/20 0.50
SLC6A2 P23975 4/20 0.50
SLC6A4 P31645 3/20 0.50
SLC6A3 Q01959 3/20 0.50
MAOA P21397 1/20 0.50
CYP2A6 P11509 1/20 0.50
ADORA2A P29274 1/20 0.50
ADORA1 P30542 1/20 0.50
SLC18A2 Q05940 1/20 0.47
CYP2D6 P10635 1/20 0.47
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
HTR1A P08908 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
DRD2 P14416 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
CNR1 P21554 1/20 0.46
HTR2A P28223 1/20 0.46

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
SCHEMBL9186461 0.84 TAAR1 (0.59) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL8761504 0.84 EPHX1 (0.52) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL10818294 0.83 TAAR1 (0.50) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL10818298 0.81 SIGMAR1 (0.48) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL3372795 0.81 CYP2D6 (0.61) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL10599610 0.80 SIGMAR1 (0.52) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL6546282 0.80 CYP2D6 (0.59) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL20714288 0.80 SIGMAR1 (0.40) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL6526877 0.79 TRPA1 (0.53) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL3372086 0.79 CYP2D6 (0.59) TAAR1SIGMAR1SLC6A2SLC6A4SLC6A3

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
JP-55048911-A None JP disclosed
CN-119751186-A Synthesis method of beta, gamma unsaturated ketone compound 中国科学院兰州化学物理研究所 2025-04-04 CN disclosed
EP-0204285-B1 IMIDAZOHETEROCYCLIC COMPOUNDS PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-01-15 EP disclosed
US-4725601-A Certain imidazo[1,2-a]pyridines useful in the treatment of ulcers FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-02-16 US disclosed
EP-0204285-A1 Imidazoheterocyclic compounds processes for preparation thereof and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-10 EP disclosed
US-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 US disclosed
JP-S5548911-A OIL CONTAINED ELECTRIC EQUIPMENT KUREHA CHEM IND CO LTD 1980-04-08 JP disclosed