SCHEMBL29804686

SCHEMBL29804686

CCCCCCCCCCCCCCCCC(C)(CCCCCCCCCCCCC)C(C)(C)C

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 0.41
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
SCHEMBL5680375 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
Hydrochloric Acid SCHEMBL28645411 0.95 TSHR (0.42) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL30525779 0.84 OPRM1 (0.38) TSHRTHRBFDPS
Ammonia Solution, Strong SCHEMBL31070822 0.84 FAAH (0.48)
SCHEMBL24926430 0.83 CES2 (0.45) TSHRTHRBGGPS1FDPSCES2
SCHEMBL20047649 0.83 CES2 (0.45) TSHRTHRBGGPS1FDPSCES2
SCHEMBL21536059 0.81 CES2 (0.43) TSHRTHRBGGPS1FDPSCES2
SCHEMBL20419702 0.78 TSHR (0.42) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL18577823 0.78 SMPD1 (0.45) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL21180176 0.78 SMPD1 (0.45) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114929748-A anti-B7-H3 monoclonal antibodies and methods of use thereof 得克萨斯州大学系统董事会 2022-08-19 CN disclosed