SCHEMBL19965165

SCHEMBL19965165

Cc1cc(Cl)nc(N2Cc3ccccc3S2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
LMNA P02545 3/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.35
MAPT P10636 2/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
CHRM1 P11229 1/20 0.32
ADRA1D P25100 1/20 0.32
ADRA1A P35348 1/20 0.32
ADRA1B P35368 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
EGFR P00533 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL19965170 0.69 KDM4E (0.39) KMT2AKDM4EALDH1A1HPGD
SCHEMBL21124462 0.68 FFAR4 (0.45) HTTLMNAPOLBMAPTALDH1A1
SCHEMBL30918019 0.66 CASP6 (0.42) HTTLMNAKMT2AMAPTL3MBTL1
SCHEMBL8572367 0.65 DRD1 (0.40) HTTLMNAKMT2AGRIN2DGRIN3B
SCHEMBL19155132 0.65 NPC1 (0.38) LMNAKMT2AMAPTALDH1A1HPGD
SCHEMBL29406937 0.65 NPC1 (0.38) LMNAKMT2AMAPTALDH1A1HPGD
SCHEMBL12344127 0.62 HTT (0.51) HTTPOLBKMT2AMAPTKDM4E
SCHEMBL3410110 0.62 HTT (0.51) HTTKMT2AKDM4EALDH1A1HPGD
SCHEMBL29826722 0.62 HTT (0.51) HTTKMT2AKDM4EALDH1A1HPGD
SCHEMBL3409761 0.61 HTT (0.50) HTTKMT2AKDM4EHPGD

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
WO-2018049324-A1 MONOCYCLIC COMPOUNDS USEFUL AS GPR120 MODULATORS NUMERATE, INC. (US) 2018-03-15 WO disclosed