SCHEMBL380353

SCHEMBL380353

COc1cccc(-c2csc3ccnc(N(C)c4ccco4)c23)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 7/20 0.43
ALDH1A1 P00352 7/20 0.43
CYP1A2 P05177 6/20 0.43
CYP3A4 P08684 6/20 0.43
CYP2D6 P10635 6/20 0.43
CYP2C19 P33261 6/20 0.43
HSD17B10 Q99714 6/20 0.43
USP2 O75604 4/20 0.43
ALOX15 P16050 3/20 0.43
PKM P14618 1/20 0.43
TP53 P04637 4/20 0.42
DYRK1A Q13627 1/20 0.40
CYP19A1 P11511 1/20 0.39
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 4/20 0.38
GLA P06280 1/20 0.38

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
SCHEMBL379746 0.85 KDR (0.39) CLK4ALDH1A1DYRK1ANPC1RAB9A
SCHEMBL379641 0.81 KDR (0.43) CLK4ALDH1A1HSD17B10ALOX15HPGD
SCHEMBL380352 0.74 HSD17B10 (0.48) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL4173391 0.73 AURKA (0.43) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL379479 0.71 PKM (0.43) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL379480 0.69 CYP1A2 (0.63) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL2368309 0.68 LMNA (0.55) CLK4ALDH1A1HSD17B10TP53DYRK1A
SCHEMBL379643 0.68 CYP1A2 (0.58) CLK4ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL12599829 0.66 PKM (0.60) CLK4ALDH1A1HSD17B10PKMDYRK1A
SCHEMBL2947614 0.65 FYN (0.54) DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1968982-B1 THIENO (3,2-C) PYRIDINE COMPOUNDS XENTION LTD (GB) 2012-01-25 EP claimed
EP-1968982-A2 THIENO (3,2-C) PYRIDINE COMPOUNDS Xention Discovery Ltd. (GB) 2008-09-17 EP claimed
US-20070161672-A1 Compounds XENTION LIMITED 2007-07-12 US claimed
WO-2007066127-A2 THIENO ( 3 , 2-C) PYRIDINE COMPOUNDS XENTION LIMITED (GB) 2007-06-14 WO claimed
US-9216992-B2 Thieno[3,2-c]pyridine potassium channel inhibitors XENTION LIMITED (GB) 2015-12-22 US disclosed
EP-1968982-B1 THIENO (3,2-C) PYRIDINE COMPOUNDS XENTION LTD (GB) 2012-01-25 EP disclosed
EP-1968982-A2 THIENO (3,2-C) PYRIDINE COMPOUNDS Xention Discovery Ltd. (GB) 2008-09-17 EP disclosed
US-20070161672-A1 Compounds XENTION LIMITED 2007-07-12 US disclosed
WO-2007066127-A2 THIENO ( 3 , 2-C) PYRIDINE COMPOUNDS XENTION LIMITED (GB) 2007-06-14 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-20070161672-A1 Compounds KCNJ2, KCNT1, KCNT2 CLK4 3601/4885ALDH1A1 371/4885CYP1A2 406/4885

“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.