SCHEMBL8684875

SCHEMBL8684875

CCCCCCCCC(C)(CCCCCCCC)CCCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
THRB P10828 1/20 0.53
GGPS1 O95749 6/20 0.44
FDPS P14324 9/20 0.42
SMPD1 P17405 2/20 0.41
CES2 O00748 1/20 0.41
LPAR1 Q92633 1/20 0.41
LPAR3 Q9UBY5 1/20 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
SCHEMBL8690491 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8687541 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8684913 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8686371 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8685403 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL11707670 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8690214 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8685221 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL20589570 1.00 TSHR (0.53) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL19032769 1.00 TSHR (0.53) 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-5728907-A Tetraalkylmethanes as synthetic lubricants PENNZOIL PRODUCTS COMPANY (US) 1998-03-17 US claimed
US-5847169-A Process for preparing oxiranemethanamine derivatives BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 1998-12-08 US disclosed
US-5728907-A Tetraalkylmethanes as synthetic lubricants PENNZOIL PRODUCTS COMPANY (US) 1998-03-17 US disclosed