SCHEMBL9851350

SCHEMBL9851350

CN1CCCCc2c1nc1cccc(Cl)c1c2N

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.61
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
NPC1 O15118 1/20 0.60
RXFP1 Q9HBX9 1/20 0.60
GRIN1 Q05586 7/20 0.60
GRIN2A Q12879 7/20 0.60
BCHE P06276 5/20 0.60
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL9851336 0.91 MEN1 (0.68) ACHEMEN1KMT2ANPC1RXFP1
SCHEMBL9851333 0.85 ACHE (0.61) ACHEMEN1KMT2ANPC1RXFP1
SCHEMBL5045645 0.81 KDM4E (0.66) ACHEMEN1KMT2AGRIN1GRIN2A
Hydrochloric Acid SCHEMBL9851346 0.79 KMT2A (0.60) ACHEMEN1KMT2ANPC1RXFP1
SCHEMBL9584574 0.76 ACHE (1.00) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL9851342 0.76 KMT2A (0.62) ACHEMEN1KMT2ANPC1RXFP1
SCHEMBL9584605 0.75 BCHE (0.97) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL9851349 0.75 ACHE (0.55) ACHEMEN1KMT2ANPC1RXFP1
SCHEMBL5686225 0.74 GRIN1 (1.00) ACHEGRIN1GRIN2ABCHEKDM4E
SCHEMBL9851389 0.71 KMT2A (0.47) ACHEMEN1KMT2ANPC1RXFP1

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