SCHEMBL2907371

SCHEMBL2907371

Cc1ccc(CNc2ccc3c(NS(=O)(=O)c4ccccc4)cccc3n2)o1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.45
MEN1 O00255 6/20 0.45
KMT2A Q03164 6/20 0.45
ALDH1A1 P00352 8/20 0.44
KDM4E B2RXH2 6/20 0.44
TSHR P16473 5/20 0.44
USP2 O75604 1/20 0.44
POLB P06746 1/20 0.44
RECQL P46063 1/20 0.44
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HSD17B10 Q99714 3/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 3/20 0.41
CASP1 P29466 1/20 0.41
SLC40A1 Q9NP59 2/20 0.41
AGTR1 P30556 1/20 0.41
GLO1 Q04760 1/20 0.41
PAX8 Q06710 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.41

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
SCHEMBL2901726 0.92 MAPT (0.46) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2904287 0.90 L3MBTL1 (0.48) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2901736 0.89 L3MBTL1 (0.40) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2907789 0.88 GLO1 (0.43) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2908628 0.87 GAA (0.43) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2907292 0.87 NPC1 (0.42) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2245273 0.85 BRD4 (0.41) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2906805 0.84 NPC1 (0.46) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2245184 0.84 NPC1 (0.39) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2907027 0.84 NFKBIA (0.46) MAPTMEN1KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101516852-B Quinoline derivatives with 5-ht-binding properties HOFFMANN LA ROCHE 2011-11-16 CN claimed
US-7825253-B2 2-aminoquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2010-11-02 US claimed
EP-2076495-B1 QUINOLINE DERIVATIVES WITH 5-HT-BINDING PROPERTIES HOFFMANN LA ROCHE (CH) 2010-08-18 EP claimed
CN-101516852-A Quinoline derivatives with 5-HT-binding properties HOFFMANN LA ROCHE (CH) 2009-08-26 CN claimed
EP-2076495-A1 QUINOLINE DERIVATIVES WITH 5-HT-BINDING PROPERTIES F.HOFFMANN-LA ROCHE AG (CH) 2009-07-08 EP claimed
WO-2008037626-A1 QUINOLINE DERIVATIVES WITH 5-HT-BINDING PROPERTIES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-03 WO claimed
US-20080081907-A1 2-AMINOQUINOLINE DERIVATIVES HOFFMANN-LA ROCHE INC. 2008-04-03 US claimed
CN-101516852-B Quinoline derivatives with 5-ht-binding properties HOFFMANN LA ROCHE 2011-11-16 CN disclosed
US-7825253-B2 2-aminoquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2010-11-02 US disclosed
EP-2076495-B1 QUINOLINE DERIVATIVES WITH 5-HT-BINDING PROPERTIES HOFFMANN LA ROCHE (CH) 2010-08-18 EP disclosed
CN-101516852-A Quinoline derivatives with 5-HT-binding properties HOFFMANN LA ROCHE (CH) 2009-08-26 CN disclosed
EP-2076495-A1 QUINOLINE DERIVATIVES WITH 5-HT-BINDING PROPERTIES F.HOFFMANN-LA ROCHE AG (CH) 2009-07-08 EP disclosed
WO-2008037626-A1 QUINOLINE DERIVATIVES WITH 5-HT-BINDING PROPERTIES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-03 WO disclosed
US-20080081907-A1 2-AMINOQUINOLINE DERIVATIVES HOFFMANN-LA ROCHE INC. 2008-04-03 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-20080081907-A1 2-AMINOQUINOLINE DERIVATIVES AR, ADRA2C, RCC2 MAPT 1716/4885MEN1 645/4885KMT2A 335/4885

“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.