SCHEMBL17175752

SCHEMBL17175752

O=C(c1ccccc1)N1CCN(S(=O)(=O)c2cccs2)CC1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.73
PKM P14618 9/20 0.67
ALDH1A1 P00352 3/20 0.65
RAB9A P51151 3/20 0.65
POLB P06746 1/20 0.59
CA9 Q16790 1/20 0.58
NPC1 O15118 1/20 0.58
MEN1 O00255 1/20 0.57

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
SCHEMBL7077235 0.86 KMT2A (0.63) KMT2APKMALDH1A1RAB9APOLB
Acetic Acid SCHEMBL27550400 0.84 KMT2A (0.58) KMT2APKMALDH1A1RAB9APOLB
SCHEMBL18711517 0.81 PKM (0.73) KMT2APKMALDH1A1RAB9APOLB
SCHEMBL10726980 0.79 LMNA (0.81) KMT2AALDH1A1CA9MEN1
SCHEMBL5322126 0.79 GCKR (0.51) KMT2APKMALDH1A1RAB9APOLB
SCHEMBL7075345 0.78 KMT2A (0.56) KMT2APKMALDH1A1RAB9APOLB
SCHEMBL30754639 0.78 PKM (0.67) KMT2APKMALDH1A1POLB
SCHEMBL28819251 0.78 PKM (0.67) KMT2APKMALDH1A1
SCHEMBL18701940 0.78 PKM (0.67) KMT2APKMALDH1A1RAB9APOLB
SCHEMBL31538999 0.77 KMT2A (0.64) KMT2APKMALDH1A1RAB9ACA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10028992-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2018-07-24 US disclosed
US-10028992-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2018-07-24 US disclosed
US-20150290276-A1 METHODS OF TREATING MUSCULAR DYSTROPHY BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE UNIVERSITY 2015-10-15 US disclosed
US-20150290276-A1 METHODS OF TREATING MUSCULAR DYSTROPHY BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE UNIVERSITY 2015-10-15 US 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 (2 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-20150290276-A1 METHODS OF TREATING MUSCULAR DYSTROPHY ITGB7, ITGA2B, ITGB1 KMT2A 3360/4885PKM 2377/4885ALDH1A1 342/4885
US-10028992-B2 Methods of treating muscular dystrophy ITGB7, ITGA2B, ITGB1 KMT2A 3360/4885PKM 2377/4885ALDH1A1 342/4885

“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.