SCHEMBL9851398

SCHEMBL9851398

Nc1c2c(nc3cccc(F)c13)N(Cc1ccccc1)CCC2

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.52
KDM4E B2RXH2 6/20 0.52
ALDH1A1 P00352 6/20 0.52
KMT2A Q03164 4/20 0.52
LMNA P02545 4/20 0.52
MAPT P10636 1/20 0.52
MEN1 O00255 3/20 0.46
NPC1 O15118 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HPGD P15428 4/20 0.43
PKM P14618 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GAA P10253 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38

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
SCHEMBL9851342 0.87 KMT2A (0.62) ACHEKDM4EALDH1A1KMT2ALMNA
SCHEMBL9851341 0.84 ALDH1A1 (0.62) ACHEKDM4EALDH1A1KMT2ALMNA
Hydrochloric Acid SCHEMBL9851346 0.83 KMT2A (0.60) ACHEKDM4EALDH1A1KMT2ALMNA
Hydrochloric Acid SCHEMBL5578403 0.82 KDM4E (0.55) ACHEKDM4EALDH1A1KMT2ALMNA
SCHEMBL4491778 0.81 ALDH1A1 (0.61) ACHEKDM4EALDH1A1KMT2ALMNA
Hydrochloric Acid SCHEMBL9851357 0.80 ALDH1A1 (0.60) ACHEKDM4EALDH1A1KMT2ALMNA
SCHEMBL1110808 0.76 ALDH1A1 (0.73) ACHEKDM4EALDH1A1KMT2ALMNA
SCHEMBL9851343 0.76 ACHE (0.51) ACHEKDM4EALDH1A1KMT2ALMNA
SCHEMBL9851389 0.75 KMT2A (0.47) ACHEKDM4EALDH1A1KMT2ALMNA
Hydrochloric Acid SCHEMBL5579198 0.75 KDM4E (0.85) ACHEKDM4EALDH1A1KMT2ALMNA

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-0430485-A2 Quinoline compound UBE INDUSTRIES, LTD. (JP) 1991-06-05 EP claimed