SCHEMBL3229122

SCHEMBL3229122

CCOc1ccc2c(c1)C(C)(c1cc(NC(=O)CCN(C)C)ccc1Cl)C(=O)N2S(=O)(=O)c1ccc(C(=O)NC(C)(C)C)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 2/20 0.49
MAPT P10636 7/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
LMNA P02545 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
GAA P10253 2/20 0.40
RAB9A P51151 1/20 0.35
HTT P42858 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ANO1 Q5XXA6 1/20 0.34
OXTR P30559 2/20 0.34
AVPR1B P47901 2/20 0.34
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL3237129 0.94 AVPR1A (0.51) AVPR1AMAPTMEN1KMT2ALMNA
SCHEMBL3235348 0.87 AVPR1A (0.51) AVPR1AMEN1KMT2ALMNARAB9A
SCHEMBL3233637 0.86 AVPR1A (0.55) AVPR1AMAPTMEN1KMT2ALMNA
SCHEMBL3230051 0.85 AVPR1A (0.55) AVPR1AMAPTMEN1KMT2ALMNA
SCHEMBL3233606 0.85 AVPR1A (0.55) AVPR1AMAPTMEN1KMT2ALMNA
SCHEMBL3234052 0.85 AVPR1A (0.55) AVPR1AMAPTMEN1KMT2ALMNA
SCHEMBL3235757 0.85 AVPR1A (0.49) AVPR1AMAPTMEN1KMT2ALMNA
SCHEMBL3237260 0.85 AVPR1A (0.56) AVPR1AMAPTMEN1KMT2ALMNA
SCHEMBL3232071 0.84 AVPR1A (0.51) AVPR1AMAPTKMT2ALMNARAB9A
SCHEMBL3266639 0.84 AVPR1A (0.56) AVPR1AMAPTMEN1KMT2ALMNA

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
EP-2097374-B1 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY AS SELECTIVE LIGANDS OF V2 VASOPRESSIN RECEPTORS SANOFI AVENTIS (FR) 2010-06-09 EP claimed
US-20100069384-A1 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2010-03-18 US claimed
US-20100069384-A1 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2010-03-18 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-20100069384-A1 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY AVPR2, AVPR1A, AVPR1B AVPR1A 2/4885MAPT 3330/4885MEN1 1684/4885

“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.