SCHEMBL6558942

SCHEMBL6558942

CCCc1n[nH]c(NC(c2ccccc2)(c2ccccc2)c2ccccc2)c1CN

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 2/20 0.39
DPP4 P27487 3/20 0.34
KIF11 P52732 2/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
KMT2A Q03164 1/20 0.32
HPGD P15428 2/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
GFER P55789 1/20 0.31
PRMT5 O14744 1/20 0.31
GRM4 Q14833 1/20 0.31
DHFR P00374 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
TAAR1 Q96RJ0 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
SCHEMBL6558385 0.89 KCNN4 (0.38) KCNN4KIF11PRMT5TAAR1
SCHEMBL6557418 0.70 HSD17B10 (0.36) KCNN4KMT2AHPGDLMNAHSD17B10
SCHEMBL6558343 0.68 NPC1 (0.41) KMT2ALMNAHSD17B10NPC1MAPT
SCHEMBL6558372 0.67 POLB (0.43) KMT2AHPGDLMNAHSD17B10MAPT
SCHEMBL6559436 0.67 MAPK1 (0.32) KMT2AHPGDLMNAHSD17B10MAPT
SCHEMBL6559547 0.66 MEN1 (0.34) KMT2AHPGDLMNAHSD17B10MAPT
SCHEMBL6557082 0.65 PRMT5 (0.40) KMT2ALMNAHSD17B10GFERPRMT5
SCHEMBL6557414 0.64 MTNR1A (0.40) KMT2AHPGDHSD17B10NPC1MAPT
SCHEMBL28794329 0.63 KCNN4 (0.37) KCNN4KMT2AHPGDLMNAHSD17B10
SCHEMBL6558387 0.63 KIF11 (0.38) KCNN4KIF11

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-1392704-A1 CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-03 EP disclosed
WO-2002090364-A1 CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 WO disclosed