SCHEMBL9624375

SCHEMBL9624375

CC(=O)c1ccccc1NS(C)(=O)=O

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.67
ALDH1A1 P00352 10/20 0.59
KDM4E B2RXH2 8/20 0.59
HPGD P15428 5/20 0.59
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MEN1 O00255 2/20 0.59
TSHR P16473 2/20 0.58
HSD17B10 Q99714 5/20 0.56
MAPK1 P28482 1/20 0.54
RCE1 Q9Y256 1/20 0.52
PKM P14618 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ATM Q13315 1/20 0.50
KEAP1 Q14145 1/20 0.50
ELANE P08246 1/20 0.50
PRTN3 P24158 1/20 0.50

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
SCHEMBL8889074 0.86 KMT2A (0.80) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL220059 0.85 KMT2A (0.72) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL8006673 0.83 KMT2A (0.65) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL1127360 0.83 KMT2A (0.65) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL7869937 0.83 KMT2A (0.65) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL13602477 0.82 ALDH1A1 (0.54) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL647703 0.81 TSHR (0.82) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL27182604 0.81 ELANE (0.51) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL530857 0.81 KMT2A (0.68) KMT2AALDH1A1KDM4EHPGDHTT
SCHEMBL19221685 0.81 HTT (0.72) KMT2AALDH1A1KDM4EHPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299055-B2 8-substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2012-10-30 US disclosed
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2010-10-14 US disclosed
US-20100152255-A1 Organic Compounds DAMON ROBERT EDSON 2010-06-17 US disclosed
US-7700637-B2 Organic compounds NOVARTIS AG (CH) 2010-04-20 US disclosed
WO-2010038465-A1 8-SUBSTITUTED ISOQUINOLINE DERIVATIVE AND USE THEREOF 旭化成ファーマ株式会社 (JP) 2010-04-08 WO disclosed
US-20070004704-A1 Such as 6-Methyl-2-[4-(5-methyl-2-phenyl-oxazol-4-ylmethoxy)-benzenesulfonylamino]-benzoic acid which binds Peroxisome Proliferator-Activated Receptors; conditions in which impaired glucose tolerance, hyperglycemia and insulin resistance are implicated, such as type-1 and type-2 diabetes, and Syndrome X NOVARTIS AG (CH) 2007-01-04 US disclosed
US-5155268-A Antiarrhythmic N-aminoalkylene alkyl and aryl sulfonamides THE UPJOHN COMPANY (US) 1992-10-13 US disclosed
EP-0164865-B1 N-(AMINOALKYLPHENYL)SULFONAMIDES THEIR PREPARATION AND THERAPEUTIC USE THE UPJOHN COMPANY (US) 1988-12-21 EP disclosed
EP-0164865-A1 N-(Aminoalkylphenyl)sulfonamides their preparation and therapeutic use THE UPJOHN COMPANY (US) 1985-12-18 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100152255-A1 Organic Compounds PPARG, FABP2, PPARA KMT2A 3326/4885ALDH1A1 453/4885KDM4E 4091/4885
US-20070004704-A1 Such as 6-Methyl-2-[4-(5-methyl-2-phenyl-oxazol-4-ylmethoxy)-benzenesulfonylamino]-benzoic acid which binds Peroxisome Proliferator-Activated Receptors; conditions in which impaired glucose tolerance, hyperglycemia and insulin resistance are implicated, such as type-1 and type-2 diabetes, and Syndrome X PPARG, GPR119, PPARA KMT2A 1633/4885ALDH1A1 845/4885KDM4E 1746/4885
US-20100261701-A1 8-Substituted isoquinoline derivative and the use thereof RELA, NFKBIA, NFKB2 KMT2A 637/4885ALDH1A1 1380/4885KDM4E 2465/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.