SCHEMBL9508070

SCHEMBL9508070

Cc1c(Cl)cc2c(c1Cl)Sc1cc(Cl)c(Cl)cc1O2

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AHR P35869 11/20 0.40
FLT1 P17948 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
SCHEMBL6308926 0.87 AHR (0.42) AHRFLT1
SCHEMBL9510063 0.79 AHR (0.36) AHRFLT1
SCHEMBL9511385 0.77 AHR (0.60) AHRFLT1
SCHEMBL9511203 0.76 AHR (0.34) AHRFLT1
SCHEMBL9508966 0.70 RHEB (0.32) AHRFLT1
SCHEMBL10652247 0.70 AHR (0.44) AHRFLT1
SCHEMBL9511418 0.69 AHR (0.33) AHR
SCHEMBL9511341 0.69 AHR (0.50) AHRFLT1
SCHEMBL9510059 0.68 AHR (0.31) AHR
SCHEMBL9508164 0.68 AHR (0.50) AHRFLT1

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 3 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
EP-0399293-A1 Process for preparing 2-chloro-4-nitro-alkylbenzene BAYER AG (DE) 1990-11-28 EP disclosed