SCHEMBL8070868

SCHEMBL8070868

CCCCCCC=CC=CCCCCCC(Cl)CCl

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
PPARG P37231 2/20 0.45
GPR132 Q9UNW8 1/20 0.45
FASN P49327 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
FAAH O00519 4/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL2369634 0.84 TSHR (0.46) ALDH1A1TSHR
SCHEMBL4896810 0.84 TSHR (0.46) ALDH1A1TSHR
SCHEMBL11402880 0.84 TSHR (0.46) ALDH1A1TSHR
SCHEMBL1412105 0.84 TSHR (0.46) ALDH1A1TSHR
SCHEMBL19462782 0.84 TSHR (0.46) ALDH1A1TSHR
SCHEMBL420467 0.84 TSHR (0.46) ALDH1A1TSHR
SCHEMBL9067354 0.82 TSHR (0.43) ALDH1A1TSHR
SCHEMBL4898877 0.82
SCHEMBL23628565 0.81 PPARG (0.42) ALDH1A1TSHRPPARGGPR132FASN
SCHEMBL30853076 0.78 TSHR (0.41) ALDH1A1TSHRPPARGGPR132FASN

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
US-6063940-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-05-16 US disclosed