SCHEMBL7787065

SCHEMBL7787065

C=C(c1ccc(C)cc1)c1ccc(C(C)(C)c2ccc(C(=C)c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
ESR1 P03372 4/20 0.44
ESR2 Q92731 3/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP3A4 P08684 2/20 0.44
AR P10275 1/20 0.44
HPGD P15428 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
HTR6 P50406 1/20 0.44
ESRRG P62508 1/20 0.44
SLC6A3 Q01959 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 1/20 0.41
GFER P55789 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
ALDH1A1 P00352 4/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL893597 0.83 HTT (0.55) HSD17B10HPGDNPC1RAB9AMAPT
SCHEMBL4412916 0.83 HTT (0.55) HSD17B10HPGDNPC1RAB9AMAPT
SCHEMBL739381 0.83 ESR1 (0.54) TSHRESR1ESR2HSD17B10CYP3A4
SCHEMBL4942966 0.81 TSHR (0.67) TSHRESR1ESR2HSD17B10CYP3A4
SCHEMBL18901114 0.81 TSHR (0.67) TSHRESR1ESR2HSD17B10CYP3A4
SCHEMBL25644886 0.77 LMNA (0.40) TSHRESR1ESR2HSD17B10CYP3A4
SCHEMBL28160104 0.77 LMNA (0.52) TSHRHSD17B10NPC1RAB9AMAPT
SCHEMBL2029880 0.76 TSHR (0.45) TSHRHSD17B10CYP3A4NPC1RAB9A
SCHEMBL18771006 0.75 TSHR (0.43) TSHRESR1ESR2HSD17B10CYP3A4
SCHEMBL7787068 0.75 SMN1; SMN2 (0.41) TSHRESR1ESR2HSD17B10CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1044226-B1 METHOD FOR COUPLING LIVING CATIONIC POLYMERS DOW CORNING (US) 2001-11-21 EP disclosed
US-6194597-B1 REACTING CATIONICALLY POLYMERIZABLE MONOMER(ISOBUTYLENE, ISOPRENE) WITH SILYL GROUP CONTAINING INITIATOR IN PRESENCE OF LEWIS ACID TO FORM LIVING CATIONIC POLYMER CONTAINING SILIY GROUPS DOW CORNING CORPORATION 2001-02-27 US disclosed
US-6051657-A Silyl-functional living cationic polymers DOW CORNING ASIA, LTD. (JP) 2000-04-18 US disclosed
US-6046281-A REACTING A LIVING CATIONIC POLYMER WITH AN ORGANIC COMPOUND HAVING AT LEAST 2 FURAN RINGS IN ITS MOLECULE, SUCH AS DIFURANYLHEXANE IN THE PRESENCE OF A LEWIS ACID UNIVERSITY OF MASSACHUSETTS LOWELL (US) 2000-04-04 US disclosed
US-5981785-A Silyl-functional initiator for living cationic polymerization UNIVERSITY OF MASSACHUSETTS (US) 1999-11-09 US disclosed