SCHEMBL5640911

SCHEMBL5640911

CC(C(=O)O)N(c1ccc(Cl)cc1)S(=O)(=O)c1ccc(OCCCN(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OXTR P30559 6/20 0.47
AVPR1A P37288 6/20 0.47
PSEN1 P49768 2/20 0.46
PSEN2 P49810 2/20 0.46
APH1B Q8WW43 2/20 0.46
NCSTN Q92542 2/20 0.46
APH1A Q96BI3 2/20 0.46
PSENEN Q9NZ42 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
BLM P54132 1/20 0.45
PMP22 Q01453 1/20 0.45
PGR P06401 1/20 0.45
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44

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
SCHEMBL3365904 0.81 OXTR (0.59) OXTRAVPR1A
SCHEMBL3363565 0.78 PGR (0.57) OXTRAVPR1ACYP1A2CYP3A4CYP2C19
SCHEMBL7147836 0.78 OXTR (0.51) OXTRAVPR1ACYP1A2CYP3A4CYP2C19
SCHEMBL5644407 0.75 OXTR (0.57) OXTRTP53MAPTALDH1A1TSHR
SCHEMBL3369291 0.75 OXTR (0.56) OXTRAVPR1ATP53MAPT
SCHEMBL3368485 0.73 PGR (0.54) TP53MAPTPGRUSP2ALDH1A1
SCHEMBL3444779 0.73 KDM4E (0.69) CYP1A2CYP3A4CYP2C19MAPTBLM
SCHEMBL3364902 0.72 CACNA1B (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3362428 0.71 PGR (0.51) OXTRAVPR1ATP53MAPTPGR
SCHEMBL3368760 0.70 CACNA1B (0.74) MAPTPGRALDH1A1HRH3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7312358-B2 Pharmaceutically active sulfanilide derivatives LABORATOIRES SERONO SA (CH) 2007-12-25 US disclosed
US-20040072816-A1 Pharmaceutically active sulfanilide derivatives MERCK SERONO SA (CH) 2004-04-15 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-20040072816-A1 Pharmaceutically active sulfanilide derivatives OXTR, AVPR2, OPRL1 OXTR 1/4885AVPR1A 4/4885PSEN1 4599/4885

“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.