SCHEMBL7201337

SCHEMBL7201337

CC(Cc1ccccc1)c1cc[c]cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
TAAR1 Q96RJ0 6/20 0.47
SIGMAR1 Q99720 5/20 0.47
MAOA P21397 4/20 0.47
SLC6A2 P23975 2/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
CYP2A6 P11509 1/20 0.47
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
SLC18A2 Q05940 1/20 0.44
CYP2D6 P10635 1/20 0.44
TRPA1 O75762 1/20 0.42
MAOB P27338 3/20 0.41
NISCH Q9Y2I1 3/20 0.41

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
SCHEMBL28859481 1.00 ESR1 (0.47) ESR1ESR2TAAR1SIGMAR1MAOA
SCHEMBL68592 0.92 ESR1 (0.47) ESR1ESR2TAAR1SIGMAR1MAOA
SCHEMBL14799062 0.85 TAAR1 (0.56) ESR1ESR2TAAR1SIGMAR1MAOA
SCHEMBL8983689 0.85 TAAR1 (0.56) ESR1ESR2TAAR1SIGMAR1MAOA
SCHEMBL535702 0.85 TAAR1 (0.56) ESR1ESR2TAAR1SIGMAR1MAOA
Ammonia Solution, Strong SCHEMBL5082413 0.83 TAAR1 (0.54) ESR1ESR2TAAR1SIGMAR1MAOA
Hydrochloric Acid SCHEMBL7266799 0.81 TAAR1 (0.52) ESR1ESR2TAAR1SIGMAR1MAOA
Methylamine SCHEMBL5328370 0.81 TAAR1 (0.58) ESR1ESR2TAAR1SIGMAR1MAOA
SCHEMBL3060894 0.81 ESR1 (0.75) ESR1ESR2TAAR1SLC6A2
SCHEMBL9069704 0.81 ESR1 (0.61) ESR1ESR2TAAR1SIGMAR1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1115284-A1 ANTIFOULING AGENTS Phycogen, Inc. (US) 2001-07-18 EP claimed
WO-2000016623-A1 ANTIFOULING AGENTS PHYCOGEN, INC. (US) 2000-03-30 WO claimed
US-6607653-B1 Tin-copper alloy plating bath, tin-copper-bismuth alloy plating bath or tin-copper-silver alloy plating bath containing a soluble metal compound and a specific sulfur-containing compound. The plating bath of the alloy with DAIWA FINE CHEMICALS CO., LTD. (JP) 2003-08-19 US disclosed
US-5847006-A Therapeutic guanidines CAMBRIDGE NEUROSCIENCE, INC. (US) 1998-12-08 US disclosed
EP-0746316-A4 THERAPEUTIC GUANIDINES CAMBRIDGE NEUROSCIENCE INC (US) 1997-12-10 EP disclosed
EP-0746316-A1 THERAPEUTIC GUANIDINES CAMBRIDGE NEUROSCIENCE, INC. (US) 1996-12-11 EP disclosed
WO-1995014467-A1 THERAPEUTIC GUANIDINES CAMBRIDGE NEUROSCIENCE, INC. (US) 1995-06-01 WO disclosed
EP-0360085-B1 OFFSET PRINTING AND OFFSET DYESTUFFS BAYER AG (DE) 1992-12-09 EP disclosed
EP-0360085-A2 Offset printing and offset dyestuffs BAYER AG (DE) 1990-03-28 EP disclosed