SCHEMBL3250672

SCHEMBL3250672

COc1cc(N)[c]cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
CYP3A4 P08684 3/20 0.38
TAAR1 Q96RJ0 1/20 0.37
POLB P06746 2/20 0.36
GAA P10253 2/20 0.36
GFER P55789 1/20 0.36
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ACHE P22303 2/20 0.33
NPC1 O15118 1/20 0.33
DHFR P00374 1/20 0.33
MAPT P10636 3/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MEN1 O00255 1/20 0.32
THRB P10828 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL5169506 0.82 CYP3A4 (0.37) ALDH1A1CYP3A4POLBGAATSHR
SCHEMBL158115 0.77 ACHE (0.36) ALDH1A1CYP3A4TAAR1GAAHSD17B10
SCHEMBL11532083 0.77 GAA (0.50) ALDH1A1CYP3A4TAAR1POLBGAA
SCHEMBL1637863 0.76 ACHE (0.39) CYP3A4TAAR1ACHEMAPTKDM4E
SCHEMBL28624535 0.74 POLB (0.34) ALDH1A1TAAR1POLBGAAGFER
SCHEMBL1636127 0.74 ACHE (0.33) ALDH1A1CYP3A4TAAR1GAATSHR
SCHEMBL5842993 0.74 TUBB1 (0.33) CYP3A4TAAR1POLBGAAACHE
SCHEMBL3226130 0.74
SCHEMBL398747 0.74 CYP3A4 (0.44) ALDH1A1CYP3A4POLBGAATSHR
SCHEMBL25182107 0.72 EP300 (0.39) ALDH1A1CYP3A4TAAR1GAATSHR

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-1776347-B1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2010-05-26 EP disclosed
US-7396958-B2 Sulphonamide derivatives, their preparation and their therapeutic application SANOFI AVENTIS (FR) 2008-07-08 US disclosed
US-20070185136-A1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2007-08-09 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-20070185136-A1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION HCRTR2, GIPR, SSTR2 ALDH1A1 2179/4885CYP3A4 4638/4885TAAR1 225/4885

“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.