SCHEMBL128573

SCHEMBL128573

O=C1Nc2cc(Cl)cc(Cl)c2C1(O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TP53 P04637 2/20 0.44
MAPT P10636 2/20 0.44
HTR6 P50406 8/20 0.40
GHSR Q92847 6/20 0.38
DRD1 P21728 1/20 0.38
AHR P35869 1/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL125679 0.82 AHR (0.40) ALDH1A1TP53MAPTHTR6GHSR
SCHEMBL6180564 0.76 ALDH1A1 (0.46) ALDH1A1TP53MAPTHTR6GHSR
SCHEMBL27927691 0.74 ALDH1A1 (0.45) ALDH1A1TP53MAPTHTR6GHSR
SCHEMBL627521 0.73 ALDH1A1 (0.39) ALDH1A1TP53MAPTHTR6GHSR
SCHEMBL5981551 0.70 ALDH1A1 (0.47) ALDH1A1TP53MAPTHTR6GHSR
SCHEMBL27402562 0.68 BRD4 (0.48) MAPT
SCHEMBL27460753 0.68 POLB (0.41) ALDH1A1MAPT
SCHEMBL27945952 0.67 ALDH1A1 (0.39) ALDH1A1TP53MAPTHTR6GHSR
SCHEMBL8097511 0.67 KCNQ3 (0.46)
SCHEMBL5982243 0.67 KCNQ3 (0.46) ALDH1A1TP53MAPTHTR6ALOX12

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-8202871-B2 Indol-2-one derivatives disubstituted in the 3-position, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2012-06-19 US disclosed
EP-2188253-B1 Indol-2-one derivatives disubstituted in 3-position, preparation thereof and therapeutic use thereof SANOFI SA (FR) 2012-03-07 EP disclosed
US-20110118280-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-05-19 US disclosed
US-20100210662-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-08-19 US disclosed
EP-2188253-A2 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2010-05-26 EP disclosed
WO-2009056707-A2 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-05-07 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-20100210662-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF IDO2, IDO1, TPH2 ALDH1A1 908/4885TP53 1799/4885MAPT 233/4885
US-20110118280-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF IDO2, IDO1, TPH2 ALDH1A1 908/4885TP53 1799/4885MAPT 233/4885

“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.