SCHEMBL11233290

SCHEMBL11233290

O=S(=O)(O)c1cccc(NCc2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
FFAR1 O14842 2/20 0.49
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48
S1PR1 P21453 1/20 0.44
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.42
CHEK1 O14757 1/20 0.40
ROCK2 O75116 1/20 0.40
RPS6KA5 O75582 1/20 0.40
MAP4K4 O95819 1/20 0.40
CHEK2 O96017 1/20 0.40
PIM1 P11309 1/20 0.40
PRKACA P17612 1/20 0.40
RPS6KB1 P23443 1/20 0.40
MAPK1 P28482 1/20 0.40
AKT1 P31749 1/20 0.40
AKT2 P31751 1/20 0.40
CLK2 P49760 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
SCHEMBL11223157 0.86 CA1 (0.49) MEN1KMT2AFFAR1MAPT
SCHEMBL11229762 0.86 MAPT (0.47) MEN1KMT2AMAPTHTT
SCHEMBL11228434 0.84 FFAR1 (0.59) MEN1KMT2AFFAR1MAPTHTT
SCHEMBL11224704 0.82 RXFP1 (0.48) MAPTHTTALDH1A1TSHR
SCHEMBL10431528 0.81 CA12 (0.51) FFAR1ALDH1A1TSHRROCK2
SCHEMBL11511594 0.81 FFAR1 (0.50) MEN1KMT2AFFAR1MAPTS1PR1
SCHEMBL11227174 0.80 PPARA (0.49)
SCHEMBL11235049 0.80 CA12 (0.52) MEN1KMT2AFFAR1MAPTHTT
SCHEMBL11225790 0.80 PPARA (0.49) MEN1KMT2AMAPTALDH1A1MAPK1
Ammonia Solution, Strong SCHEMBL10582019 0.80 CA12 (0.50) FFAR1ALDH1A1TSHRROCK2

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-4328244-A ANTIVIRAL AGENT THE DOW CHEMICAL COMPANY (US) 1982-05-04 US disclosed