SCHEMBL30853100

SCHEMBL30853100

C=CC=CCCCCC(Cl)CCC

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ALDH1A1 P00352 1/20 0.33
PPARG P37231 2/20 0.33
GPR132 Q9UNW8 1/20 0.33
FASN P49327 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL30853121 0.98 PPARG (0.35) TSHRALDH1A1PPARGGPR132FASN
SCHEMBL30853076 0.93 TSHR (0.41) TSHRALDH1A1PPARGGPR132FASN
SCHEMBL30853158 0.78 TSHR (0.33) TSHRALDH1A1PPARGGPR132FASN
SCHEMBL8332552 0.78 FFAR1 (0.40) TSHRALDH1A1PPARGGPR132FASN
SCHEMBL28633267 0.78 FFAR1 (0.40) TSHRALDH1A1PPARGGPR132FASN
SCHEMBL30853111 0.78 TSHR (0.33) TSHRALDH1A1PPARGGPR132FASN
SCHEMBL8332550 0.78 FFAR1 (0.40) TSHRALDH1A1PPARGGPR132FASN
SCHEMBL5853710 0.77 FFAR1 (0.35) PPARGGPR132KMT2A
SCHEMBL5853705 0.77 FFAR1 (0.35) PPARGGPR132KMT2A
SCHEMBL20503621 0.76 FFAR1 (0.42) ALDH1A1PPARGGPR132FASNMEN1

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-117924017-A Organic halogen compound having conjugated double bond, method for preparing acetate and alcohol derivative thereof, and compound for synthesizing the compound 信越化学工业株式会社 2024-04-26 CN disclosed