SCHEMBL7993033

SCHEMBL7993033

CCc1ccc(OC(=O)NC(=N)c2cc[c]cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.48
S1PR3 Q99500 2/20 0.39
ALDH1A1 P00352 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
PLK1 P53350 1/20 0.36
NPC1 O15118 2/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
MGLL Q99685 1/20 0.36
FAAH O00519 2/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL7986173 0.90 THRB (0.46) RAB9AALDH1A1PLK1NPC1MAPT
SCHEMBL7989584 0.87 THRB (0.44) ALDH1A1PLK1MAPTMGLLFAAH
SCHEMBL7975491 0.87 PTGS2 (0.41) RAB9ANPC1LMNA
SCHEMBL7974855 0.86 KMT2A (0.43) RAB9AALDH1A1TDP1PLK1NPC1
SCHEMBL7989521 0.85 LMNA (0.42) S1PR3ALDH1A1TDP1LMNA
SCHEMBL7988304 0.85 SMN1; SMN2 (0.44) RAB9AS1PR3ALDH1A1PLK1NPC1
SCHEMBL7985763 0.84 FAAH (0.47) PLK1MAPTFAAHLMNASMN1; SMN2
SCHEMBL7986382 0.84 FAAH (0.53) NPC1MGLLFAAHLMNASMN1; SMN2
SCHEMBL7992755 0.82 SMN1; SMN2 (0.49) RAB9AALDH1A1RXRARXRBNPC1
SCHEMBL7985699 0.82 FAAH (0.51) NPC1FAAHLMNASMN1; SMN2

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
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed