SCHEMBL21708484

SCHEMBL21708484

CCCCC(=O)Oc1cc(F)ccc1C

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
RECQL P46063 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
ACHE P22303 1/20 0.46
HTR7 P34969 1/20 0.45
ALOX15 P16050 1/20 0.45
POLM Q9NP87 1/20 0.42
POLK Q9UBT6 1/20 0.42
POLL Q9UGP5 1/20 0.42
POLH Q9Y253 1/20 0.42
HPGD P15428 1/20 0.40
FPR1 P21462 1/20 0.39
TOP2A P11388 1/20 0.39
LMNA P02545 1/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL15550319 0.88 ALOX15 (0.57) KMT2AKDM4EMEN1RECQLSMN1; SMN2
SCHEMBL1994828 0.86 KMT2A (0.54) KMT2AKDM4EMEN1RECQLSMN1; SMN2
SCHEMBL29009914 0.84 KMT2A (0.51) KMT2AKDM4EMEN1RECQLSMN1; SMN2
SCHEMBL15558476 0.83 ALOX15 (0.63) KMT2AKDM4EMEN1RECQLHTR7
SCHEMBL1997560 0.83 KMT2A (0.54) KMT2AKDM4EMEN1RECQLSMN1; SMN2
SCHEMBL15558002 0.82 ALOX15 (0.62) KMT2AKDM4EMEN1RECQLSMN1; SMN2
SCHEMBL15558761 0.82 ALOX15 (0.62) KMT2AKDM4EMEN1RECQLSMN1; SMN2
SCHEMBL499472 0.81 KMT2A (0.67) KMT2AKDM4EMEN1RECQLSMN1; SMN2
SCHEMBL249930 0.81 TYR (0.54) ACHE
SCHEMBL27739467 0.81 KMT2A (0.51) KMT2AKDM4EMEN1RECQLSMN1; SMN2

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-3609870-A1 SUBSTITUTED N-ARYLETHYL-2-AMINOQUINOLINE-4-CARBOXAMIDES AND USE THEREOF Bayer Aktiengesellschaft (DE) 2020-02-19 EP disclosed