SCHEMBL4590146

SCHEMBL4590146

COc1cccc(C2(Cl)C(=O)Nc3ccc(Cl)cc32)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDYL Q9Y232 3/20 0.56
CBX7 O95931 1/20 0.56
MDM2 Q00987 4/20 0.55
TP53 P04637 2/20 0.55
PGR P06401 3/20 0.48
ADAMTS5 Q9UNA0 2/20 0.46
MAOB P27338 1/20 0.43
CDYL2 Q8N8U2 2/20 0.42
CDY1; CDY1B Q9Y6F8 1/20 0.42
IDO1 P14902 1/20 0.41
SCN9A Q15858 1/20 0.41
BRD4 O60885 1/20 0.41
HTR6 P50406 1/20 0.39

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
SCHEMBL4590436 0.88 ADAMTS5 (0.48) CDYLCBX7MDM2TP53PGR
SCHEMBL27485165 0.87 PGR (0.48) CDYLCBX7MDM2TP53PGR
SCHEMBL4588841 0.85 ADAMTS5 (0.54) CDYLCBX7MDM2TP53ADAMTS5
SCHEMBL2499643 0.84 CDYL (0.60) CDYLCBX7MDM2TP53PGR
SCHEMBL27681626 0.84 CDYL (0.55) CDYLCBX7MDM2TP53PGR
SCHEMBL27484820 0.82 PGR (0.44) CDYLCBX7MDM2TP53PGR
SCHEMBL4590061 0.80 CBX7 (0.47) CDYLCBX7MDM2PGRADAMTS5
SCHEMBL4588923 0.80 ADAMTS5 (0.48) CDYLCBX7MDM2TP53PGR
SCHEMBL4590048 0.80 MDM2 (0.50) CDYLCBX7MDM2TP53PGR
SCHEMBL4588940 0.77 CBX7 (0.45) CDYLCBX7PGRADAMTS5MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7425566-B2 1,3-dihydro-2H-indol-2-one derivatives, process for preparing them and pharmaceutical compositions containing them SANOFI-AVENTIS (FR) 2008-09-16 US disclosed
US-20050176770-A1 Novel 1,3-dihydro-2H-indol-2-one derivatives, process for preparing them and pharmaceutical compositions containing them SANOFI-AVENTIS (FR) 2005-08-11 US disclosed
US-6864277-B2 1,3-dihydro-2H-indol-2-one derivatives, method for preparing same and pharmaceutical compositions containing them SANOFI-SYNTHELABO (FR) 2005-03-08 US disclosed
US-20030162767-A1 With affinity for and selectivity towards the V1b receptors or both the V1b and V1a receptors of arginine-vasopressin SANOFI-AVENTIS (FR) 2003-08-28 US disclosed
EP-1296976-A1 NOVEL 1,3-DIHYDRO-2H-INDOL-ONE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Sanofi-Aventis (FR) 2003-04-02 EP disclosed
WO-2001098295-A1 NOVEL 1,3-DIHYDRO-2H-INDOL-ONE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2001-12-27 WO 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 (2 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-20030162767-A1 With affinity for and selectivity towards the V1b receptors or both the V1b and V1a receptors of arginine-vasopressin AVPR1B, AVPR1A, AVPR2 CDYL 4544/4885CBX7 4049/4885MDM2 1889/4885
US-20050176770-A1 Novel 1,3-dihydro-2H-indol-2-one derivatives, process for preparing them and pharmaceutical compositions containing them AVPR1B, AVPR2, AVPR1A CDYL 3213/4885CBX7 3930/4885MDM2 1110/4885

“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.