SCHEMBL18173883

SCHEMBL18173883

O=C(O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.79
PKM P14618 2/20 0.70
RAB9A P51151 3/20 0.70
NPC1 O15118 2/20 0.70
KMT2A Q03164 4/20 0.69
MEN1 O00255 2/20 0.69
POLB P06746 2/20 0.69
ALDH1A1 P00352 2/20 0.69
MAPK1 P28482 2/20 0.69
HPGD P15428 1/20 0.69
ALOX15 P16050 1/20 0.69
HSD17B10 Q99714 1/20 0.69
RXFP1 Q9HBX9 1/20 0.64
GAA P10253 1/20 0.63
KDM4E B2RXH2 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61

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
SCHEMBL26597984 0.85 KMT2A (0.74) MAPTPKMRAB9ANPC1KMT2A
SCHEMBL20777400 0.82 KMT2A (1.00) MAPTPKMRAB9ANPC1KMT2A
SCHEMBL29188512 0.80 KMT2A (0.69) MAPTPKMRAB9ANPC1KMT2A
SCHEMBL10008213 0.79 KMT2A (0.70) MAPTPKMRAB9ANPC1KMT2A
SCHEMBL10008995 0.78 KMT2A (0.71) MAPTPKMRAB9ANPC1KMT2A
SCHEMBL20773061 0.78 KMT2A (0.70) MAPTPKMRAB9ANPC1KMT2A
SCHEMBL13875710 0.77 GAA (0.94) MAPTPKMKMT2AMEN1POLB
SCHEMBL2593770 0.77 KMT2A (0.75) MAPTPKMRAB9AKMT2AMEN1
SCHEMBL19018960 0.76 POLB (0.64) MAPTPKMKMT2AMEN1POLB
SCHEMBL10009399 0.75 KMT2A (0.71) MAPTPKMRAB9ANPC1KMT2A

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-10968183-B2 Small molecule FIEL1 inhibitor in inflammatory and fibrotic lung injury University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2021-04-06 US disclosed
US-10344003-B2 Small molecule FIEL1 inhibitor in inflammatory and fibrotic lung injury University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2019-07-09 US disclosed
US-20180141916-A1 NOVEL SMALL MOLECULE FIEL1 INHIBITOR IN INFLAMMATORY AND FIBROTIC LUNG INJURY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2018-05-24 US disclosed
WO-2016172325-A1 NOVEL SMALL MOLECULE FIEL1 INHIBITOR IN INFLAMMATORY AND FIBROTIC LUNG INJURY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2016-10-27 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 (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-10344003-B2 Small molecule FIEL1 inhibitor in inflammatory and fibrotic lung injury FIP1L1, TRIM28, TFPI2 MAPT 4203/4885PKM 4293/4885RAB9A 2622/4885
US-20180141916-A1 NOVEL SMALL MOLECULE FIEL1 INHIBITOR IN INFLAMMATORY AND FIBROTIC LUNG INJURY FIP1L1, TRIM28, TFPI2 MAPT 4247/4885PKM 4280/4885RAB9A 2169/4885
US-10968183-B2 Small molecule FIEL1 inhibitor in inflammatory and fibrotic lung injury FIP1L1, TRIM28, TFPI2 MAPT 4203/4885PKM 4293/4885RAB9A 2622/4885

“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.