SCHEMBL6986135

SCHEMBL6986135

COc1cc2cc[c]cc2[nH]1

nearest known ligand 0.30

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.30
MAPT P10636 2/20 0.30
RAB9A P51151 2/20 0.30
NPC1 O15118 1/20 0.30
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
AXL P30530 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
SCHEMBL4473896 0.87 AXL (0.34) KDM4EMAPTRAB9ANPC1CASP3
SCHEMBL1746068 0.75 KEAP1 (0.42) KDM4EMAPTALDH1A1HPGDAXL
SCHEMBL16719715 0.74 MAPT (0.37) MAPTALDH1A1HPGD
SCHEMBL827599 0.72 KDM4E (0.53) KDM4EMAPTRAB9ANPC1CASP3
SCHEMBL18227588 0.71
SCHEMBL1937603 0.71
SCHEMBL16720367 0.71 KDM4E (0.50) KDM4EMAPTRAB9ANPC1CASP3
SCHEMBL8146071 0.70 LOXL2 (0.35) KDM4EMAPTALDH1A1
SCHEMBL5778197 0.69 DAO (0.38)
SCHEMBL5775364 0.68 KDM4E (0.39) KDM4EMAPTMEN1ALDH1A1KMT2A

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-1289954-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
WO-2001096303-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 WO disclosed