SCHEMBL6182237

SCHEMBL6182237

CCCCCCCCCCCCCCC(C)(C)C=S

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
GGPS1 O95749 6/20 0.37
FDPS P14324 9/20 0.35
DNM1 Q05193 2/20 0.35
HTT P42858 1/20 0.35
SMPD1 P17405 2/20 0.34
CES2 O00748 1/20 0.34
LPAR1 Q92633 1/20 0.34
LPAR3 Q9UBY5 1/20 0.34

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
SCHEMBL18731508 0.80 TSHR (0.40) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL277708 0.78
SCHEMBL28111389 0.77 TSHR (0.42) TSHRTHRBGGPS1FDPSDNM1
SCHEMBL28792359 0.77 TSHR (0.42) TSHRTHRBGGPS1FDPSDNM1
SCHEMBL11669918 0.77 TSHR (0.42) TSHRTHRBGGPS1FDPSDNM1
SCHEMBL28062516 0.77 TSHR (0.42) TSHRTHRBGGPS1FDPSDNM1
SCHEMBL27509150 0.76 TSHR (0.36) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL23790491 0.75 GGPS1 (0.41) TSHRTHRBGGPS1FDPSDNM1
SCHEMBL5498660 0.75 TSHR (0.44) TSHRTHRBGGPS1FDPSCES2
SCHEMBL22807004 0.75 TSHR (0.44) TSHRTHRBGGPS1FDPSDNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912521-B1 SUBSTITUTED INDAZOLE DERIVATIVES AND THEIR USE AS INHIBITORS PHOSPHODIESTERASE (PDE) TYPE IV AND THE PRODUCTION OF TUMOR NECROSIS FACTOR (TNF) PFIZER (US) 2005-04-06 EP claimed
EP-0828741-B1 SPIROCYCLIC AND BICYCLIC DIAZINYL AND CARBAZINYL OXAZOLIDINONES UPJOHN CO (US) 2001-08-29 EP claimed
EP-0636025-B1 COMPOUNDS USEFUL FOR TREATING ALLERGIC OR INFLAMMATORY DISEASES SMITHKLINE BEECHAM CORP (US) 2001-07-18 EP claimed
EP-0727990-B1 COMPOUNDS, COMPOSITIONS AND TREATMENT OF ALLERGIES AND INFLAMMATION SMITHKLINE BEECHAM CORP (US) 2001-06-13 EP claimed