SCHEMBL31290786

SCHEMBL31290786

O=S(=O)(Cl)c1ccc2cnccc2c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 5/20 0.43
PIK3CA P42336 1/20 0.42
CYP19A1 P11511 2/20 0.40
IDO1 P14902 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ROCK2 O75116 5/20 0.38
ROCK1 Q13464 5/20 0.38
JAK2 O60674 4/20 0.38
JAK3 P52333 4/20 0.38
IKBKB O14920 3/20 0.38
JAK1 P23458 2/20 0.38
TYK2 P29597 2/20 0.38
NR3C1 P04150 1/20 0.38
PRMT3 O60678 1/20 0.38
NOTUM Q6P988 2/20 0.37

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
SCHEMBL567493 1.00 IMPDH2 (0.43) IMPDH2PIK3CACYP19A1IDO1ALDH1A1
Bromide SCHEMBL22129647 0.98 IMPDH2 (0.42) IMPDH2PIK3CACYP19A1IDO1ALDH1A1
Hydrochloric Acid SCHEMBL22129650 0.98 IMPDH2 (0.42) IMPDH2PIK3CACYP19A1IDO1ALDH1A1
Phosphoric Acid SCHEMBL22129649 0.95 IMPDH2 (0.43) IMPDH2PIK3CAROCK2ROCK1JAK2
Sulfuric Acid SCHEMBL22129651 0.95 IMPDH2 (0.43) IMPDH2PIK3CACYP19A1ROCK2ROCK1
SCHEMBL5217117 0.93 PRKCZ (0.43) IMPDH2PIK3CACYP19A1IDO1ALDH1A1
SCHEMBL30357699 0.82 LMNA (0.48) ALDH1A1HSD17B10TDP1
SCHEMBL2263563 0.82 LMNA (0.48) ALDH1A1HSD17B10TDP1
SCHEMBL24064830 0.81 IMPDH2 (0.43) IMPDH2PIK3CACYP19A1IDO1ROCK2
SCHEMBL11146201 0.81 NAPRT (0.48) IMPDH2CYP19A1ALDH1A1HSD17B10ROCK2

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
EP-3900724-B1 ISOQUINOLINE SULFONYL CHLORIDE ACID ADDITION SALTS AND METHOD OF MANUFACTURE THEREOF D WESTERN THERAPEUTICS INST INC (JP) 2025-02-05 EP claimed