SCHEMBL11207182

SCHEMBL11207182

C=CCOc1nc(O)nc(OCC2CO2)n1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
MAPT P10636 3/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 3/20 0.33
TSHR P16473 3/20 0.33
HIF1A Q16665 2/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GLA P06280 1/20 0.32
GPR84 Q9NQS5 3/20 0.31
HPGD P15428 2/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
KMT2A Q03164 1/20 0.30
PPARG P37231 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL4155468 0.94 ALDH1A1 (0.53) ALDH1A1MAPTMAPK1TDP1TP53
SCHEMBL11190248 0.94 ALDH1A1 (0.53) ALDH1A1MAPTMAPK1TDP1TP53
SCHEMBL3677603 0.87 TDP1 (0.42) ALDH1A1MAPTMAPK1TDP1TP53
SCHEMBL16880542 0.83 TDP1 (0.42) ALDH1A1MAPTMAPK1TDP1TP53
SCHEMBL6545804 0.83 TDP1 (0.42) ALDH1A1MAPTMAPK1TDP1TP53
SCHEMBL154305 0.83 MAPT (0.47) MAPTMAPK1TSHRSMN1; SMN2HPGD
SCHEMBL336841 0.79 MAPT (0.47) MAPTMAPK1TSHRSMN1; SMN2HPGD
SCHEMBL487480 0.79 TDP1 (0.48) ALDH1A1MAPTMAPK1TDP1TP53
SCHEMBL29398866 0.79 TDP1 (0.48) ALDH1A1MAPTMAPK1TDP1TP53
SCHEMBL29397562 0.79 TDP1 (0.48) ALDH1A1MAPTMAPK1TDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0019113-B1 AROMATIC POLYAMIDE PAPER-LIKE SHEET AND PROCESSES FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 1983-04-13 EP claimed