SCHEMBL5955992

SCHEMBL5955992

COc1ccc(Oc2ccc(C(N)=O)c(NS(=O)(=O)c3ccc4ccccc4c3)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 1/20 0.55
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
PGR P06401 2/20 0.52
POLB P06746 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
PRSS1 P07477 3/20 0.51
PRSS2 P07478 3/20 0.51
PRSS3 P35030 3/20 0.51
ST14 Q9Y5Y6 2/20 0.51
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PLA2G7 Q13093 1/20 0.50
HSD17B10 Q99714 1/20 0.50
F2 P00734 2/20 0.48
F10 P00742 1/20 0.48
CKS1B P61024 1/20 0.48
SKP2 Q13309 1/20 0.48

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
SCHEMBL5955997 0.84 MEN1 (0.58) KMT2AMEN1PGRPOLBTDP1
SCHEMBL5955962 0.83 USP2 (0.57) CYP2C9CYP2C19KMT2AMEN1PGR
SCHEMBL7208212 0.80 ALDH1A1 (0.63) KMT2AMEN1POLBTDP1PRSS1
SCHEMBL5956141 0.76 CYP2C9 (0.68) CYP2C9CYP2C19KMT2AMEN1TDP1
SCHEMBL9927442 0.75 KMT2A (0.78) KMT2AMEN1POLBTDP1ALDH1A1
SCHEMBL8752432 0.74 PLAU (0.76) KMT2AMEN1PGRALDH1A1SMN1; SMN2
SCHEMBL7313843 0.74 ALDH1A1 (0.60) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL5955308 0.74 PGR (0.70) CYP2C9CYP2C19KMT2APGRALDH1A1
SCHEMBL5955986 0.73 MRGPRX1 (0.49)
SCHEMBL5956219 0.73 KEAP1 (0.63) KMT2APGRALDH1A1SMN1; SMN2HSD17B10

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
WO-2006014405-A2 SULFONAMIDE-BASED COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-02-09 WO claimed
US-20060004197-A1 Sulfonamide-based compounds as protein tyrosine kinase inhibitors BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2006-01-05 US claimed
WO-2006014405-A2 SULFONAMIDE-BASED COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-02-09 WO disclosed
US-20060004197-A1 Sulfonamide-based compounds as protein tyrosine kinase inhibitors BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2006-01-05 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 (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-20060004197-A1 Sulfonamide-based compounds as protein tyrosine kinase inhibitors SRC, LCK, ABL1 CYP2C9 4172/4885CYP2C19 3983/4885KMT2A 324/4885

“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.