SCHEMBL7811989

SCHEMBL7811989

CN(c1ccccc1)S(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.71
CA9 Q16790 1/20 0.71
ESR1 P03372 8/20 0.68
NPC1 O15118 1/20 0.67
RAB9A P51151 1/20 0.67
TSHR P16473 1/20 0.62
ALDH1A1 P00352 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
NR1H3 Q13133 1/20 0.60
MAPT P10636 2/20 0.59
MEN1 O00255 1/20 0.59
LMNA P02545 1/20 0.59
HTT P42858 1/20 0.59
KMT2A Q03164 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
NR1I2 O75469 1/20 0.57
HSD17B1 P14061 1/20 0.56
HSD17B2 P37059 1/20 0.56
MCOLN3 Q8TDD5 1/20 0.56
LIMK2 P53671 1/20 0.56

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
SCHEMBL6301401 0.93 NPC1 (0.67) CA12CA9ESR1NPC1RAB9A
SCHEMBL5623176 0.90 ALDH1A1 (0.71) CA12CA9ESR1NPC1RAB9A
SCHEMBL812702 0.86 CA12 (0.78) CA12CA9TSHRL3MBTL1NR1H3
SCHEMBL18031174 0.84 MAPT (0.82) CA12CA9ESR1NPC1RAB9A
SCHEMBL6302212 0.84 MAPT (0.82) CA12CA9ESR1NPC1RAB9A
SCHEMBL6794824 0.83 CA12 (0.73) CA12CA9TSHRL3MBTL1NR1H3
SCHEMBL3822617 0.83 CA12 (1.00) CA12CA9TSHRALDH1A1L3MBTL1
SCHEMBL13190025 0.83 ALDH1A1 (0.62) CA12CA9ESR1NPC1RAB9A
SCHEMBL7175900 0.82 ALDH1A1 (0.61) CA12CA9ESR1NPC1RAB9A
SCHEMBL7267942 0.82 ALDH1A1 (0.61) CA12CA9ESR1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160244462-A1 6-NITRO-2,3-DIHYDROIMIDAZO[2,1-b]OXAZOLES AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-08-25 US disclosed
US-20160244462-A1 6-NITRO-2,3-DIHYDROIMIDAZO[2,1-b]OXAZOLES AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-08-25 US disclosed
CN-1077888-C Benzopyrans and pharmaceutical compositions containing them NOVARTIS AG (CH) 2002-01-16 CN disclosed
EP-0828733-B1 BENZOPYRANS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 2001-09-05 EP disclosed
US-5905156-A POTASSIUM CHANNEL ACTIVATORS AND BRONCHODILATORS NOVARTIS AG (CH) 1999-05-18 US disclosed
CN-1185153-A Benzopyrans and pharmaceutical composition contg. same CIBA GEIGY AG (CH) 1998-06-17 CN disclosed
EP-0828733-A1 BENZOPYRANS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Novartis AG (CH) 1998-03-18 EP disclosed
WO-1996037490-A1 BENZOPYRANS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 1996-11-28 WO 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 (1 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-20160244462-A1 6-NITRO-2,3-DIHYDROIMIDAZO[2,1-b]OXAZOLES AND A PROCESS FOR THE PREPARATION THEREOF XDH, DHFR, G6PD CA12 4828/4885CA9 3839/4885ESR1 4749/4885

“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.