SCHEMBL7659041

SCHEMBL7659041

COCCNS(=O)(=O)c1cc(C(=O)Nc2ccc(/C=C/c3ccc(NC(=O)c4ccc(S(C)(=O)=O)c([N+](=O)[O-])c4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)ccc1OC

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 6/20 0.49
MEN1 O00255 9/20 0.47
KMT2A Q03164 9/20 0.47
GAA P10253 1/20 0.46
VCAM1 P19320 1/20 0.43
POLB P06746 3/20 0.43
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
RAD51 Q06609 1/20 0.42
RAB9A P51151 1/20 0.42
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL7659054 1.00 ALDH1A1 (0.49) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL7661342 0.94 ALDH1A1 (0.45) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL7661355 0.94 ALDH1A1 (0.45) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL7668618 0.89 MAPT (0.61) ALDH1A1LMNAMAPTGAAPOLB
SCHEMBL7668690 0.89 MAPT (0.61) ALDH1A1LMNAMAPTGAAPOLB
SCHEMBL8019214 0.86 MEN1 (0.43) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL7662894 0.84 VCAM1 (0.53) ALDH1A1MAPTMEN1KMT2AVCAM1
SCHEMBL7659049 0.84 VCAM1 (0.53) ALDH1A1MAPTMEN1KMT2AVCAM1
SCHEMBL8019665 0.80 VCAM1 (0.48) ALDH1A1MAPTMEN1KMT2AVCAM1
SCHEMBL8019666 0.80 VCAM1 (0.48) ALDH1A1MAPTMEN1KMT2AVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020111369-A1 Aryl sulfonic acids and derivatives as FSH antagonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-08-15 US claimed
US-20020111369-A1 Aryl sulfonic acids and derivatives as FSH antagonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-08-15 US disclosed
US-6355633-B1 CONTRACEPTIVES AMERICAN HOME PRODUCTS CORPORATION 2002-03-12 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-20020111369-A1 Aryl sulfonic acids and derivatives as FSH antagonists FSHR, GNRHR, LHCGR ALDH1A1 3990/4885LMNA 3330/4885MAPT 4858/4885

“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.