SCHEMBL11238532

SCHEMBL11238532

C=Cc1ccccc1C(Cl)C(Cl)Cl

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TSHR P16473 1/20 0.32

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
SCHEMBL148998 0.82 ALDH1A1 (0.50) ALDH1A1TSHR
SCHEMBL29749279 0.82 ALDH1A1 (0.50) ALDH1A1TSHR
SCHEMBL1507296 0.80 ALDH1A1 (0.48) ALDH1A1TSHR
SCHEMBL7635775 0.78 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL727276 0.78 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL16395493 0.77 ALDH1A1 (0.45) ALDH1A1TSHR
Chloroform SCHEMBL27939469 0.76 ALDH1A1 (0.59) ALDH1A1TSHR
SCHEMBL23748278 0.75 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL2944385 0.75 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL1507374 0.74 ALDH1A1 (0.42) ALDH1A1TSHR

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
US-4324581-A ALPHA-TRICHLOROETHYL-M-HALOSTYRENE THE DOW CHEMICAL COMPANY (US) 1982-04-13 US disclosed
US-4086081-A PREEMERGENCE HERBICIDES THE DOW CHEMICAL COMPANY (US) 1978-04-25 US disclosed