SCHEMBL27362934

SCHEMBL27362934

CCOC(=O)c1csc2nc(-c3ccc(NC(C)=O)cc3)cn12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.59
TP53 P04637 5/20 0.59
SMN1; SMN2 Q16637 5/20 0.54
NPC1 O15118 5/20 0.54
RAB9A P51151 5/20 0.54
RXFP1 Q9HBX9 2/20 0.50
PRKCZ Q05513 1/20 0.50
GAA P10253 3/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
GABRA2 P47869 1/20 0.45
GABRB2 P47870 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
CYP1A2 P05177 1/20 0.44
GLA P06280 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GFER P55789 1/20 0.44
FLT3 P36888 1/20 0.43

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
SCHEMBL27362937 0.85 MAPT (0.59) MAPTTP53NPC1RXFP1HPGD
SCHEMBL20538978 0.78 CDC7 (0.50) MAPTTP53SMN1; SMN2NPC1RAB9A
SCHEMBL2564662 0.73 IDO1 (0.43) MAPTTP53SMN1; SMN2NPC1RAB9A
SCHEMBL13470766 0.73 ALDH1A1 (0.43) MAPTTP53SMN1; SMN2NPC1RAB9A
SCHEMBL11327747 0.73 GAA (0.45) MAPTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL2624439 0.72 IDO1 (0.41) MAPTTP53RXFP1KDM4EALDH1A1
SCHEMBL11160167 0.72 KDM4E (0.55) MAPTSMN1; SMN2NPC1RAB9ARXFP1
SCHEMBL221297 0.72 IDO1 (0.42) MAPTTP53NPC1RAB9ARXFP1
SCHEMBL13470789 0.72 ALDH1A1 (0.40) MAPTTP53GAAKDM4EALDH1A1
SCHEMBL12875755 0.72 MAPT (0.49) MAPTTP53SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250313532-A1 ALDH2 INHIBITORS AND METHODS OF USE THEREOF UNIVERSITY OF MARYLAND, BALTIMORE 2025-10-09 US disclosed
WO-2023235753-A2 ALDH2 INHIBITORS AND METHODS OF USE THEREOF UNIVERSITY OF MARYLAND, BALTIMORE (US) 2023-12-07 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-20250313532-A1 ALDH2 INHIBITORS AND METHODS OF USE THEREOF ADH1A, ALDH1A1, ADH1C MAPT 1666/4885TP53 2469/4885SMN1; SMN2 2772/4885

“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.