SCHEMBL7659006

SCHEMBL7659006

COCCN(CCOC)S(=O)(=O)c1cc(C(=O)Nc2ccc(/C=C/c3ccc(NC(=O)c4ccc(OC)c(S(=O)(=O)N(CCOC)CCOC)c4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)ccc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD51 Q06609 1/20 0.48
TP53 P04637 2/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
GAA P10253 1/20 0.46
CYP2C9 P11712 1/20 0.46
KMT2A Q03164 1/20 0.46
ENPP2 Q13822 1/20 0.45
MAPT P10636 5/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 1/20 0.42
USP2 O75604 1/20 0.41
GSTO1 P78417 1/20 0.41
CASR P41180 1/20 0.41
MAPK1 P28482 1/20 0.41
MCHR1 Q99705 1/20 0.41

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
SCHEMBL7659067 1.00 RAD51 (0.48) RAD51TP53MEN1CYP1A2CYP3A4
SCHEMBL7662975 0.90 CYP1A2 (0.57) RAD51TP53MEN1CYP1A2CYP3A4
SCHEMBL7663040 0.90 CYP1A2 (0.57) RAD51TP53MEN1CYP1A2CYP3A4
SCHEMBL8019545 0.87 TP53 (0.48) TP53MEN1CYP1A2CYP3A4GAA
SCHEMBL7668690 0.84 MAPT (0.61) RAD51TP53GAAENPP2MAPT
SCHEMBL7668618 0.84 MAPT (0.61) RAD51TP53GAAENPP2MAPT
SCHEMBL8022348 0.80 MEN1 (0.51) TP53MEN1CYP1A2CYP3A4GAA
SCHEMBL7657417 0.78 RAB9A (0.66) MEN1GAAKMT2AMAPTALDH1A1
SCHEMBL7657503 0.78 RAB9A (0.66) MEN1GAAKMT2AMAPTALDH1A1
SCHEMBL7666022 0.77 RAB9A (0.65) MEN1GAAKMT2AMAPTALDH1A1

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 RAD51 2639/4885TP53 4371/4885MEN1 1956/4885

“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.