SCHEMBL1630232

SCHEMBL1630232

CCOc1cccc(-c2nnc(C)o2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.56
SMN1; SMN2 Q16637 7/20 0.56
ALDH1A1 P00352 7/20 0.56
HPGD P15428 7/20 0.56
TP53 P04637 6/20 0.56
RAB9A P51151 6/20 0.56
HSD17B10 Q99714 5/20 0.56
MAPT P10636 4/20 0.56
TSHR P16473 3/20 0.56
MAPK1 P28482 2/20 0.56
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
NPC1 O15118 5/20 0.55
BRD4 O60885 1/20 0.52
BRD2 P25440 1/20 0.52
CREBBP Q92793 1/20 0.52
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 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
SCHEMBL10834901 0.84 TP53 (0.46) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL10835842 0.83 TP53 (0.45) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL10054151 0.83 KDM4E (0.69) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL8111957 0.81 KDM4E (0.55) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL11166490 0.81 ALDH1A1 (0.57) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL8282012 0.81 KDM4E (0.71) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL1186459 0.80 MAOB (0.51) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL12896087 0.79 PIM1 (0.52) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL25469661 0.78 SMN1; SMN2 (0.43) KDM4ESMN1; SMN2ALDH1A1HPGDTP53
SCHEMBL12171427 0.78 ALDH1A1 (0.67) KDM4ESMN1; SMN2ALDH1A1HPGDTP53

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
US-7932390-B2 Substituted thieno[3,2-C]pyridine carboxylic acid derivatives HOFFMAN-LA ROCHE INC. (US) 2011-04-26 US disclosed
EP-2038288-B1 NOVEL 4-AMINO-3-(-AZOLYL-PHENOXYMETHYL)-THIENOÝ3,2¨PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-11-24 EP disclosed
EP-2038288-A1 NOVEL 4-AMINO-3-(-AZOLYL-PHENOXYMETHYL)-THIENOÝ3,2¨PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2009-03-25 EP disclosed
US-20080009515-A1 Substituted thieno[3,2-C]pyridine carboxylic acid derivatives CHEN YI 2008-01-10 US disclosed
WO-2008000697-A1 NOVEL 4-AMINO-3-(-AZOLYL-PHENOXYMETHYL)-THIENO[3,2]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-01-03 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-20080009515-A1 Substituted thieno[3,2-C]pyridine carboxylic acid derivatives UQCRB, UQCRC2, AURKB KDM4E 1751/4885SMN1; SMN2 4044/4885ALDH1A1 379/4885

“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.