SCHEMBL31399980

SCHEMBL31399980

Cc1cccc2nc(Cl)c(Cl)nc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 2/20 0.46
RAB9A P51151 2/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.40
ALDH1A1 P00352 3/20 0.40
RXFP1 Q9HBX9 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
MGAM O43451 3/20 0.39
GAA P10253 3/20 0.39
SI P14410 3/20 0.39
MGAM2 Q2M2H8 3/20 0.39
NQO2 P16083 3/20 0.38
PKM P14618 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
G6PD P11413 1/20 0.38
ACHE P22303 1/20 0.37

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
SCHEMBL2423180 1.00 TDP1 (0.52) TDP1MAPTRAB9AMAPK1L3MBTL1
SCHEMBL14764520 0.88 MAPT (0.44) TDP1MAPTRAB9AMAPK1L3MBTL1
SCHEMBL14764415 0.88 MAPT (0.44) TDP1MAPTRAB9AMAPK1L3MBTL1
SCHEMBL31643056 0.84 RAB9A (0.53) MAPTRAB9AMAPK1ALDH1A1GAA
SCHEMBL20475325 0.84 RAB9A (0.53) MAPTRAB9AMAPK1ALDH1A1GAA
SCHEMBL14842553 0.80 KDM4E (0.62) TDP1MAPTRAB9AMAPK1L3MBTL1
SCHEMBL183009 0.77 NQO2 (0.57) MAPTRAB9AMAPK1L3MBTL1ALDH1A1
SCHEMBL8604288 0.77 MAPT (0.52) MAPTRAB9AMAPK1ALDH1A1GAA
SCHEMBL7527351 0.77 TDP1 (0.56) TDP1MAPTRAB9AMAPK1ALDH1A1
SCHEMBL23886102 0.76 DRD4 (0.46) MAPTRAB9AMAPK1L3MBTL1ALDH1A1

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
WO-2025021868-A1 TRAF2 INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER DISEASES Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) 2025-01-30 WO disclosed