SCHEMBL11274262

SCHEMBL11274262

O=c1n(-c2cc(Cl)c(Cl)cc2Cl)cnn1SC(Cl)(Cl)Cl

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.40

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
SCHEMBL11275450 0.84 HCAR1 (0.45) HCAR1
SCHEMBL11268746 0.81 HCAR1 (0.43) HCAR1
SCHEMBL11275593 0.79 SMN1; SMN2 (0.44)
SCHEMBL11267538 0.78 CYP11B2 (0.32)
SCHEMBL11260819 0.74 HCAR1 (0.44) HCAR1
SCHEMBL11267429 0.74 MAPT (0.41)
SCHEMBL11263206 0.74 HCAR1 (0.42) HCAR1
SCHEMBL11266715 0.73 HCAR1 (0.43) HCAR1
SCHEMBL11268398 0.72 ALDH1A1 (0.41) HCAR1
SCHEMBL11266662 0.71 PTGS2 (0.42)

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-4350701-A 1-(Trihalomethyl-sulfenyl)-4-aryl-1,2,4-triazolin-5-ones, and process for controlling fungi BASF AKTIENGESELLSCHAFT (DE) 1982-09-21 US disclosed