SCHEMBL7813191

SCHEMBL7813191

CCc1cccc2c(NC3CCCC3)c(C(C)=O)c(=O)[nH]c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
DAO P14920 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 3/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 3/20 0.36
TSHR P16473 3/20 0.36
PLA2G7 Q13093 3/20 0.35
KDM4E B2RXH2 3/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 1/20 0.35
NFKB1 P19838 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
SCHEMBL7816938 0.70 DAO (0.38) NPC1RAB9APOLBSMN1; SMN2DAO
SCHEMBL7809669 0.69 DAO (0.40) NPC1RAB9APOLBRXFP1DAO
SCHEMBL7809663 0.67 DAO (0.38) POLBDAOKMT2AALDH1A1LMNA
SCHEMBL6884900 0.67 KMT2A (0.47) NPC1RAB9ASMN1; SMN2KMT2AALDH1A1
SCHEMBL7813741 0.66 KDM4E (0.45) POLBSMN1; SMN2DAOKMT2AALDH1A1
SCHEMBL7812826 0.64 KDM4E (0.38) SMN1; SMN2DAOKMT2AALDH1A1PLA2G7
SCHEMBL14916363 0.64 LMNA (0.48) RAB9ASMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL28668184 0.63 JAK2 (0.44) NPC1RAB9AKMT2AALDH1A1HSD17B10
SCHEMBL28648810 0.62 IDO1 (0.40) NPC1RAB9AKMT2AALDH1A1LMNA
SCHEMBL9390027 0.61 DAO (0.68) DAOALDH1A1LMNAPLA2G7KDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0533882-B1 2-QUINOLINONE DERIVATIVES, METHODS FOR PREPARING THE SAME AND FUNGICIDES AND INSECTICIDES INCLUDING THEM KOREA RES INST CHEM TECH (KR) 2001-02-07 EP disclosed
US-5430153-A Insecticides, fungicides KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-07-04 US disclosed
EP-0533882-A1 2-QUINOLINONE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-03-31 EP disclosed
WO-1992017452-A1 2-QUINOLINONE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-10-15 WO disclosed