SCHEMBL20979463

SCHEMBL20979463

C/C(=N\NC(=O)c1cccc(SN2CCOCC2)c1)c1ccnc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
MTOR P42345 6/20 0.47
KDM1A O60341 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 3/20 0.45
LMNA P02545 2/20 0.45
HPGD P15428 1/20 0.45
BRD4 O60885 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
BRD2 P25440 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL20979469 0.84 RAB9A (0.56) MAPTMTORSMN1; SMN2ALDH1A1LMNA
SCHEMBL20979562 0.82 MAPT (0.47) MAPTMTORKDM1ASMN1; SMN2ALDH1A1
SCHEMBL14712677 0.81 KDM1A (0.67) MAPTKDM1AALDH1A1BRD4CYP3A4
SCHEMBL15772891 0.81 KDM1A (0.67) MAPTKDM1AALDH1A1BRD4CYP3A4
SCHEMBL15772892 0.81 KDM1A (0.67) MAPTKDM1AALDH1A1BRD4CYP3A4
SCHEMBL20979705 0.80 KDM1A (0.60) MAPTMTORKDM1ASMN1; SMN2ALDH1A1
SCHEMBL20979632 0.80 KDM1A (0.50) MAPTMTORKDM1ASMN1; SMN2ALDH1A1
SCHEMBL20979576 0.80 KDM1A (0.72) MAPTMTORKDM1ASMN1; SMN2ALDH1A1
SCHEMBL20979477 0.80 KDM1A (0.59) MAPTMTORKDM1ASMN1; SMN2ALDH1A1
Hydrogen Sulfide SCHEMBL22213028 0.79 MAPT (0.44) MAPTMTORKDM1ASMN1; SMN2ALDH1A1

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
EP-2744330-B1 SUBSTITUTED (E)-N'-(1-PHENYLETHYLIDENE) BENZOHYDRAZIDE ANALOGS AS HISTONE DEMETHYLASE INHIITORS UNIV UTAH RES FOUND (US) 2020-07-15 EP disclosed
EP-3010915-B1 SUBSTITUTED (3-(5-CHLORO-2-HYDROXYPHENYL)-1-BENZOYL-1H-PYRAZOLE COMPOUNDS AS HISTONE DEMETHYLASE INHIBITORS UNIV UTAH RES FOUND (US) 2019-05-08 EP disclosed