SCHEMBL11224704

SCHEMBL11224704

O=S(=O)(O)c1cccc(NCc2c(Cl)cccc2Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.48
ADRA2B P18089 1/20 0.47
ALDH1A1 P00352 4/20 0.43
HTT P42858 3/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
GAA P10253 2/20 0.43
PLA2G1B P04054 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43
KCNJ6 P48051 1/20 0.42
KCNJ5 P48544 1/20 0.42
KCNJ3 P48549 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 1/20 0.42
CASR P41180 2/20 0.42
POLB P06746 2/20 0.42
CA1 P00915 3/20 0.42
ACHE P22303 1/20 0.42

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
SCHEMBL11225084 0.87 KCNJ5 (0.51) ALDH1A1MAPTGAAKCNJ6KCNJ5
SCHEMBL11226051 0.84 RXFP1 (0.61) RXFP1ADRA2BALDH1A1HTTMAPT
SCHEMBL11233290 0.82 MEN1 (0.52) ALDH1A1HTTMAPTTSHR
SCHEMBL11223157 0.82 CA1 (0.49) MAPTKCNJ6KCNJ5KCNJ3POLB
SCHEMBL11229762 0.82 MAPT (0.47) HTTMAPTCA1CA2PGR
SCHEMBL11230361 0.81 CA12 (0.43) ADRA2BALDH1A1HTTMAPTL3MBTL1
SCHEMBL10431528 0.79 CA12 (0.51) ALDH1A1TSHRCASRCA1CA2
Ammonia Solution, Strong SCHEMBL10582019 0.78 CA12 (0.50) ALDH1A1TSHRCASRCA1CA2
SCHEMBL11510231 0.78 GAA (0.53) ALDH1A1HTTMAPTKDM4EGAA
SCHEMBL6240600 0.77 CA1 (0.48) ALDH1A1TDP1TSHRHSD17B10CASR

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