SCHEMBL4476668

SCHEMBL4476668

O=S(=O)(NCc1ccc(C(F)(F)F)cc1)c1ccc2c(O)cccc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.60
NSD2 O96028 2/20 0.49
POLB P06746 2/20 0.48
RECQL P46063 1/20 0.48
NAMPT P43490 2/20 0.47
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
SCN3A Q9NY46 1/20 0.46
SCN5A Q14524 2/20 0.46
SCN9A Q15858 2/20 0.46
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
CASP1 P29466 1/20 0.45
HTT P42858 1/20 0.45
CASP7 P55210 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
CNR1 P21554 1/20 0.44
CA2 P00918 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL4472758 0.88 HDAC3 (0.54) CYP19A1POLBNAMPTLMNAALDH1A1
SCHEMBL4472784 0.85 CYP19A1 (0.62) CYP19A1POLBLMNAALDH1A1HPGD
SCHEMBL4465917 0.82 CYP19A1 (0.52) CYP19A1NSD2POLBRECQLNAMPT
SCHEMBL4478227 0.79 CYP19A1 (0.61) CYP19A1POLBCA2
SCHEMBL4485514 0.78 NSD2 (0.73) CYP19A1NSD2POLBRECQLNAMPT
SCHEMBL7169118 0.77 CYP19A1 (0.67) CYP19A1NSD2NAMPTLMNASCN3A
SCHEMBL4480958 0.76 CYP19A1 (0.66) CYP19A1POLBALDH1A1CA2SMN1; SMN2
SCHEMBL4478162 0.76 CA2 (0.56) CYP19A1POLBALDH1A1HSD17B10CA2
SCHEMBL9813031 0.75 CYP19A1 (0.82) CYP19A1NAMPTLMNARAB9ASCN3A
SCHEMBL4493195 0.74 NSD2 (0.52) CYP19A1NSD2POLBNAMPTALDH1A1

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-7598418-B2 Naphthalene-1-(sulfonamide or carboxamide) derivatives; e.g. N-Benzyl-5-{[(4-methylphenyl)sulfonyl]oxy}naphthalene-1-sulfonamide; protein kinase inhibitors sensitize cancer cells to radiotherapy or anticancer agents; side effect reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-10-06 US claimed
US-20050215645-A1 Amide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2005-09-29 US claimed
US-7598418-B2 Naphthalene-1-(sulfonamide or carboxamide) derivatives; e.g. N-Benzyl-5-{[(4-methylphenyl)sulfonyl]oxy}naphthalene-1-sulfonamide; protein kinase inhibitors sensitize cancer cells to radiotherapy or anticancer agents; side effect reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-10-06 US disclosed
US-20050215645-A1 Amide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2005-09-29 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-20050215645-A1 Amide derivatives OGG1, HDAC1, BCL2A1 CYP19A1 552/4885NSD2 639/4885POLB 296/4885

“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.