SCHEMBL476641

SCHEMBL476641

Cc1cc2ccccc2n1CCCNS(C)(=O)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.61
KMT2A Q03164 10/20 0.61
CYP1A2 P05177 3/20 0.61
CYP3A4 P08684 3/20 0.61
CYP2D6 P10635 3/20 0.61
CYP2C19 P33261 3/20 0.61
CYP2C9 P11712 2/20 0.61
CASP1 P29466 2/20 0.61
USP2 O75604 1/20 0.61
ESR1 P03372 1/20 0.61
MAPT P10636 7/20 0.58
POLB P06746 3/20 0.58
FGB P02675 1/20 0.58
TP53 P04637 4/20 0.56
TSHR P16473 4/20 0.56
KDM4E B2RXH2 3/20 0.56
HTT P42858 3/20 0.55
SMN1; SMN2 Q16637 5/20 0.52
ALDH1A1 P00352 3/20 0.52
NPC1 O15118 2/20 0.52

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
SCHEMBL476604 0.79 RECQL (0.41) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL476538 0.79 SMN1; SMN2 (0.40) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL476681 0.79 MEN1 (0.39) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL476636 0.77 HTR7 (0.39) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL29430384 0.77 HTT (0.54) TP53TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL9277138 0.76 TP53 (0.53) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL30628011 0.76 MEN1 (0.64) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL4220374 0.76 MEN1 (0.64) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL9776118 0.75 TP53 (0.56) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL30151601 0.74 MEN1 (0.58) MEN1KMT2ACYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1951225-B1 3-ACYLINDOLE DERIVATIVES THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI SA (FR) 2012-02-01 EP disclosed
US-7741363-B2 3-Acylindole derivatives, preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-06-22 US disclosed
US-20080275102-A1 3-ACYLINDOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2008-11-06 US disclosed
EP-1951225-A2 3-ACYLINDOLE DERIVATIVES THE PREPARATION AND THE THERAPEUTIC USE THEREOF sanofi-aventis (FR) 2008-08-06 EP disclosed
WO-2007057571-A2 3-ACYLINDOLE DERIVATIVES THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-05-24 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 (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-20080275102-A1 3-ACYLINDOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF F12, ECI1, NQO2 MEN1 1241/4885KMT2A 1799/4885CYP1A2 18/4885

“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.