SCHEMBL9728472

SCHEMBL9728472

Cc1ccccc1C(=O)Nc1nc2ccccc2c(=O)n1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.57
MAPT P10636 2/20 0.57
ALDH1A1 P00352 1/20 0.57
KMT2A Q03164 5/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PDE11A Q9HCR9 1/20 0.52
PDE10A Q9Y233 1/20 0.52
HTT P42858 3/20 0.51
GAA P10253 2/20 0.51
HPGD P15428 1/20 0.49
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
BACE1 P56817 1/20 0.47
PTGER4 P35408 1/20 0.47
USP2 O75604 1/20 0.47
MAPK1 P28482 1/20 0.47
CYP1A2 P05177 1/20 0.46

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
SCHEMBL9728467 0.84 RAB9A (0.72) KDM4EMAPTALDH1A1KMT2ANPC1
SCHEMBL9728645 0.82 RAB9A (0.61) KDM4EMAPTALDH1A1KMT2ANPC1
SCHEMBL9728332 0.81 MAPT (0.52) KDM4EMAPTALDH1A1KMT2ANPC1
SCHEMBL5178791 0.73 ALDH1A1 (0.54) KDM4EMAPTALDH1A1KMT2ANPC1
SCHEMBL10004321 0.72 KDM4E (0.58) KDM4EMAPTALDH1A1KMT2ANPC1
SCHEMBL12567028 0.72 GAA (0.50) MAPTALDH1A1KMT2ANPC1SMN1; SMN2
SCHEMBL32666080 0.72 KDM4E (0.69) KDM4EMAPTALDH1A1KMT2ANPC1
SCHEMBL1101889 0.69 KDM4E (0.66) KDM4EMAPTALDH1A1KMT2ANPC1
SCHEMBL9823743 0.69 KDM4E (0.64) KDM4EMAPTALDH1A1KMT2ANPC1
SCHEMBL9728402 0.68 RAB9A (0.57) KDM4EMAPTALDH1A1KMT2ANPC1

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-5084457-A Cognition activators and nervous system disorders AMERICAN CYANAMID COMPANY (US) 1992-01-28 US claimed
US-5084457-A Cognition activators and nervous system disorders AMERICAN CYANAMID COMPANY (US) 1992-01-28 US disclosed