SCHEMBL11223157

SCHEMBL11223157

O=S(=O)(O)c1cccc(NCc2ccc(Cl)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49
PPARA Q07869 1/20 0.49
LMNA P02545 2/20 0.47
KCNJ6 P48051 1/20 0.47
KCNJ5 P48544 1/20 0.47
KCNJ3 P48549 1/20 0.47
FBP1 P09467 1/20 0.47
MAPT P10636 2/20 0.45
HDAC1 Q13547 1/20 0.44
EGFR P00533 1/20 0.44
FFAR1 O14842 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP19A1 P11511 2/20 0.43
POLB P06746 1/20 0.42
NPY1R P25929 1/20 0.42
NPY2R P49146 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
SCHEMBL11229762 0.88 MAPT (0.47) CA1CA2FBP1MAPTHDAC1
SCHEMBL10431528 0.86 CA12 (0.51) CA1CA2CA12CA9FFAR1
SCHEMBL11233290 0.86 MEN1 (0.52) MAPTFFAR1MEN1KMT2A
SCHEMBL2850048 0.85 LMNA (0.47) CA1CA2CA12CA9PPARA
SCHEMBL11235049 0.85 CA12 (0.52) CA1CA2CA12CA9LMNA
SCHEMBL11227174 0.85 PPARA (0.49) CA1CA2CA12CA9PPARA
SCHEMBL11225790 0.85 PPARA (0.49) CA1CA2CA12PPARAMAPT
Ammonia Solution, Strong SCHEMBL10582019 0.85 CA12 (0.50) CA1CA2CA12CA9FFAR1
SCHEMBL11231951 0.85 NPC1 (0.46) CA1CA2CA12PPARALMNA
SCHEMBL11224704 0.82 RXFP1 (0.48) CA1CA2CA12CA9LMNA

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