SCHEMBL8752452

SCHEMBL8752452

COc1cc(NS(=O)(=O)c2ccccc2)cc(OC)c1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PGR P06401 5/20 0.67
SMN1; SMN2 Q16637 3/20 0.64
LMNA P02545 2/20 0.64
HTR6 P50406 1/20 0.63
CYP19A1 P11511 1/20 0.61
TP53 P04637 1/20 0.59
IL1RN P18510 1/20 0.58
KEAP1 Q14145 1/20 0.58
ERAP1 Q9NZ08 1/20 0.58
CYTH2 Q99418 1/20 0.57
ALDH1A1 P00352 2/20 0.56
GAA P10253 1/20 0.56
PKM P14618 2/20 0.56
MAPT P10636 1/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL20523540 0.89 HTR6 (0.56) PGRSMN1; SMN2LMNAHTR6CYP19A1
SCHEMBL4662755 0.87 PGR (0.72) PGRSMN1; SMN2LMNACYP19A1TP53
SCHEMBL4822277 0.85 SMN1; SMN2 (0.67) SMN1; SMN2LMNAHTR6CYP19A1GAA
SCHEMBL4662975 0.84 PGR (0.82) PGRSMN1; SMN2LMNACYP19A1IL1RN
SCHEMBL5289106 0.83 SMN1; SMN2 (0.65) SMN1; SMN2LMNAHTR6CYP19A1TP53
SCHEMBL7823465 0.83 HTR6 (0.88) SMN1; SMN2LMNAHTR6CYP19A1PKM
SCHEMBL22792319 0.83 SLC22A12 (0.63) PGRSMN1; SMN2LMNACYP19A1IL1RN
SCHEMBL29031235 0.83 PGR (0.85) PGRSMN1; SMN2LMNACYP19A1KEAP1
SCHEMBL22653519 0.82 AKR1C3 (0.62) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL812663 0.81 PGR (0.82) PGRSMN1; SMN2LMNACYP19A1IL1RN

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0610653-B1 Thermosensitive recording material NEW OJI PAPER CO LTD (JP) 1997-04-16 EP claimed
US-5444036-A Arylsulfonylureido compound, acetoacetanilide compound, sulfonamide derivative; storage stability NEW OIL PAPER CO., LTD. (JP) 1995-08-22 US claimed
EP-0610653-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-08-17 EP claimed
EP-0610653-B1 Thermosensitive recording material NEW OJI PAPER CO LTD (JP) 1997-04-16 EP disclosed
US-5444036-A Arylsulfonylureido compound, acetoacetanilide compound, sulfonamide derivative; storage stability NEW OIL PAPER CO., LTD. (JP) 1995-08-22 US disclosed
EP-0610653-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-08-17 EP disclosed