SCHEMBL9210359

SCHEMBL9210359

CCCCCCCCCCC(C)(C)[NH]

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
THRB P10828 1/20 0.47
GGPS1 O95749 6/20 0.46
FDPS P14324 9/20 0.39
SMPD1 P17405 2/20 0.38
CES2 O00748 1/20 0.38
LPAR1 Q92633 1/20 0.38
LPAR3 Q9UBY5 1/20 0.38

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
SCHEMBL9210992 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9210950 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9214400 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9203965 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL7165612 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8768304 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9213934 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9211829 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9209061 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9214423 1.00 TSHR (0.47) 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
EP-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed
EP-0421441-A2 Pantothenic acid derivatives FUJIREBIO INC. (JP) 1991-04-10 EP disclosed