SCHEMBL8670818

SCHEMBL8670818

CCCCCCCCCC(C)(C)SSSSSSC(C)(C)CCCCCCCCC

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
GGPS1 O95749 6/20 0.35
FDPS P14324 9/20 0.34
SMPD1 P17405 2/20 0.33
CES2 O00748 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR3 Q9UBY5 1/20 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
SCHEMBL10850267 1.00 TSHR (0.38) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL1203599 1.00 TSHR (0.38) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL661472 1.00 TSHR (0.38) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL7187123 0.98 TSHR (0.33) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL3517300 0.98 TSHR (0.40) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL1255777 0.98 TSHR (0.40) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9083035 0.93 TSHR (0.40) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL7777463 0.93 TSHR (0.40) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9493244 0.87 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL728106 0.87 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5777188-A POLYSULFIDES PHILLIPS PETROLEUM COMPANY (US) 1998-07-07 US disclosed
WO-1997045506-A1 TREATING CRACKING TUBE FOR THERMAL CRACKING TO REDUCE CARBON MONOXIDE AND/OR COKE FORMATION PHILLIPS PETROLEUM COMPANY (US) 1997-12-04 WO disclosed
US-3976769-A INSECTICIDE AIRWICK INDUSTRIES, INC. (US) 1976-08-24 US disclosed