SCHEMBL2593902

SCHEMBL2593902

CSc1nc2ccc(N)cc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.65
SMN1; SMN2 Q16637 7/20 0.65
HPGD P15428 7/20 0.65
MEN1 O00255 9/20 0.59
KMT2A Q03164 9/20 0.59
RXFP1 Q9HBX9 3/20 0.59
CACNA1B Q00975 1/20 0.59
APBA1 Q02410 1/20 0.59
MAPT P10636 12/20 0.57
KDM4E B2RXH2 10/20 0.57
GAA P10253 9/20 0.57
NPC1 O15118 6/20 0.57
RAB9A P51151 6/20 0.57
GLA P06280 5/20 0.57
GFER P55789 3/20 0.57
RECQL P46063 3/20 0.57
POLB P06746 5/20 0.54
BLM P54132 4/20 0.54
HSD17B10 Q99714 3/20 0.54
PKM P14618 3/20 0.54

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
SCHEMBL17076824 0.86 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL4597364 0.80 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2HPGDKMT2AMAPT
SCHEMBL20683082 0.79 HPGD (0.65) ALDH1A1SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8667804 0.79 HPGD (1.00) ALDH1A1SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL17085004 0.76 HPGD (0.61) ALDH1A1SMN1; SMN2HPGDCYP3A4CYP1A2
SCHEMBL7672276 0.76 CYP2E1 (0.70) ALDH1A1SMN1; SMN2HPGDKDM4ENPC1
SCHEMBL1925827 0.76 MAPT (0.76) ALDH1A1SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL521629 0.75 MAPT (0.68) ALDH1A1SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL725354 0.75 PLAU (0.66) ALDH1A1SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL11098109 0.75 HPGD (0.59) ALDH1A1SMN1; SMN2HPGDMAPTGAA

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
CN-120036308-A Deodorizing and disinfecting spray composition and preparation method and application thereof 奥洁玛(北京)生物科技有限公司 2025-05-27 CN disclosed
EP-2563143-A1 SUBSTITUTED 1,3-BENZOTHIAZOL-2(3H)-ONES AND [1,3]THIAZOLO[5,4-B]PYRIDIN-2(1H)-ONES AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 Merck Sharp & Dohme Corp. (US) 2013-03-06 EP disclosed
WO-2011137046-A1 SUBSTITUTED 1,3-BENZOTHIAZOL-2(3H)-ONES AND [1,3]THIAZOLO[5,4-B]PYRIDIN-2(1H)-ONES AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 MERCK SHARP & DOHME CORP. (US) 2011-11-03 WO disclosed