SCHEMBL16230017

SCHEMBL16230017

CCc1c(C(=O)NC(C)(C)CO)[nH]c2cc(C)n(CC(=O)c3ccccc3)c(=O)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.41
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ CNR1 P21554 2/20 0.34
▸ EGFR P00533 2/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ MEN1 O00255 3/20 0.33
▸ GAA P10253 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ POLB P06746 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SMO Q99835 1/20 0.33
▸ BLM P54132 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL16230015 0.80 L3MBTL1 (0.40) LMNANPC1RAB9AEGFRCDK2
SCHEMBL16230012 0.74 EGFR (0.37) LMNARAB9ACNR1EGFRCDK2
SCHEMBL10316151 0.73 SMO (0.52) NPC1RAB9AATMCNR1CNR2
SCHEMBL13708874 0.69 LMNA (0.46) LMNARAB9AMEN1GAAKMT2A
SCHEMBL621869 0.64 POLB (0.71) LMNANPC1RAB9AATMCNR1
SCHEMBL7847521 0.62 LMNA (0.41) LMNANPC1RAB9AMEN1GAA
SCHEMBL27836537 0.62 LMNA (0.57) LMNANPC1RAB9AATMMEN1
SCHEMBL10314639 0.61 LMNA (0.56) LMNANPC1RAB9AMEN1GAA
SCHEMBL12962930 0.61 LMNA (0.43) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL13708880 0.61 LMNA (0.53) LMNANPC1RAB9AMEN1GAA

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-2471791-B1 FUSED HETEROCYCLIC RING DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2014-11-12 — — EP disclosed
Send feedback