SCHEMBL8329374

SCHEMBL8329374

Clc1cccc([C](CCCc2ccccc2)CCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.51
CTSB P07858 2/20 0.51
PLAAT3 P53816 4/20 0.50
PLAAT5 Q96KN8 4/20 0.50
PLAAT2 Q9NWW9 4/20 0.50
PLAAT4 Q9UL19 4/20 0.50
NPC1 O15118 1/20 0.47
CASP3 P42574 1/20 0.47
RAB9A P51151 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KCNH2 Q12809 1/20 0.45
GRIN2B Q13224 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL12040536 0.72 TAAR1 (0.59) PLAAT3PLAAT5PLAAT2PLAAT4MEN1
SCHEMBL28107403 0.72 BCHE (0.56) NPC1RAB9ATDP1MEN1KMT2A
SCHEMBL155800 0.71 TDP1 (0.55) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL657718 0.71 PLAAT3 (0.57) CTSLCTSBPLAAT3PLAAT5PLAAT2
SCHEMBL7375927 0.71 TBXAS1 (0.55) TDP1KMT2AL3MBTL1
SCHEMBL6983189 0.71 GRIN2B (0.50) CTSLCTSBPLAAT3PLAAT5PLAAT2
SCHEMBL5024832 0.70 SMN1; SMN2 (0.68) PLAAT3PLAAT5PLAAT2PLAAT4MEN1
SCHEMBL23071686 0.69 TAAR1 (0.65) PLAAT3PLAAT5PLAAT2PLAAT4MEN1
SCHEMBL10336435 0.69 TDP1 (0.60) PLAAT3PLAAT5PLAAT2PLAAT4NPC1
SCHEMBL27472305 0.68 PLAAT3 (0.60) PLAAT3PLAAT5PLAAT2PLAAT4MEN1

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-0948496-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE Amgen inc. (US) 1999-10-13 EP disclosed
WO-1998024780-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE AMGEN INC. (US) 1998-06-11 WO disclosed