SCHEMBL9511249

SCHEMBL9511249

Cc1c2c(cc(Cl)c1C(F)(F)F)Sc1cc(C#N)c(Cl)cc1S2

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 16/20 0.34
SLC22A12 Q96S37 2/20 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
SCHEMBL9511297 0.80 PGK1 (0.31)
SCHEMBL9510064 0.75 TRPV4 (0.43) AR
SCHEMBL24275900 0.66 AR (0.49) AR
SCHEMBL18179221 0.63 AR (0.46) ARSLC22A12
SCHEMBL9511227 0.62 USP8 (0.33)
SCHEMBL9511376 0.61 AHR (0.39)
SCHEMBL27413813 0.60 AR (0.49) AR
SCHEMBL13755144 0.60 AR (0.45) AR
SCHEMBL25616938 0.60 AR (0.46) AR
SCHEMBL10441636 0.60 AR (0.42) ARSLC22A12

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
EP-0399293-B1 PROCESS FOR PREPARING 2-CHLORO-4-NITRO-ALKYLBENZENE BAYER AG (DE) 1993-09-01 EP disclosed
US-5095157-A Friedel-crafts catalyst BAYER AKTIENGESELLSCHAFT (DE) 1992-03-10 US disclosed