SCHEMBL9602938

SCHEMBL9602938

[Li]c1cccc2c1C([Si](C)(C)C)c1ccccc1-2

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.34
HTR2A P28223 1/20 0.31
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30

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
Hydrochloric Acid SCHEMBL4633144 0.80 GPR3 (0.35) GPR3HTR2APOLB
SCHEMBL28226566 0.79 GPR3 (0.34) GPR3HTR2APOLB
SCHEMBL9633188 0.79 HPGD (0.36) GPR3ALDH1A1
SCHEMBL6671925 0.78 GPR3 (0.46) GPR3HTR2AALDH1A1POLB
SCHEMBL30390148 0.78 GPR3 (0.46) GPR3HTR2AALDH1A1POLB
Hydrochloric Acid SCHEMBL8080602 0.77 GPR3 (0.33) GPR3
Hydrochloric Acid SCHEMBL4633591 0.75 CYP19A1 (0.33) GPR3
SCHEMBL6544747 0.71 GPR3 (0.34) GPR3HTR2APOLB
SCHEMBL8587289 0.71 HTR2A (0.42) GPR3HTR2AALDH1A1
SCHEMBL5175634 0.69 GPR3 (0.46) GPR3HTR2AALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5148166-A None JP disclosed
JP-H05148166-A NEW FLUORENYL COMPOUND AND ITS PREPARATION PHILLIPS PETROLEUM CO 1993-06-15 JP disclosed