SCHEMBL8040729

SCHEMBL8040729

CC(C)CNC(=O)c1ccc(C2CC2c2ccc(Cl)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.57
NPC1 O15118 1/20 0.57
ALDH1A1 P00352 1/20 0.57
LMNA P02545 1/20 0.57
ALOX12 P18054 1/20 0.57
KCNH2 Q12809 1/20 0.57
HPGD P15428 2/20 0.54
MLYCD O95822 1/20 0.50
KDM4E B2RXH2 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 1/20 0.48
HSD17B10 Q99714 1/20 0.48
EPHX2 P34913 2/20 0.47
PRMT5 O14744 2/20 0.46
GPR139 Q6DWJ6 1/20 0.46
P2RX3 P56373 1/20 0.45
P2RX7 Q99572 1/20 0.45

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
SCHEMBL17865783 0.78 MLYCD (0.73) RAB9ANPC1ALDH1A1LMNAALOX12
SCHEMBL8038465 0.78 RAB9A (0.48) RAB9ANPC1ALDH1A1LMNAALOX12
SCHEMBL17660271 0.78 MLYCD (0.56) RAB9ANPC1ALDH1A1LMNAALOX12
SCHEMBL21501024 0.76 ALDH1A1 (0.49) RAB9ANPC1ALDH1A1HPGDKDM4E
SCHEMBL19835585 0.76 MEN1 (0.58) RAB9ANPC1ALDH1A1LMNAALOX12
SCHEMBL15087817 0.76 MEN1 (0.58) RAB9ANPC1ALDH1A1LMNAALOX12
SCHEMBL19836092 0.76 MEN1 (0.58) RAB9ANPC1ALDH1A1LMNAALOX12
SCHEMBL7212094 0.74 CYP1A2 (0.57) RAB9ANPC1ALDH1A1LMNAALOX12
SCHEMBL104285 0.74 HPGD (0.63) RAB9ANPC1ALDH1A1LMNAALOX12
SCHEMBL10144118 0.72 ALDH1A1 (1.00) RAB9ANPC1ALDH1A1LMNAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6159973-A Aromatic amides, their preparation process, the compositions containing them and their use as pesticides HOECHST SCHERING AGREVO S.A. (FR) 2000-12-12 US disclosed
EP-0805795-B1 NOVEL AROMATIC AMIDES, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME, AND USE THEREOF AS PESTICIDES HOECHST SCHERING AGREVO SA (FR) 2000-08-23 EP disclosed
US-6013837-A E.G.,4-(2-(3,4,5-TRICHLORO PHENYL) 1-FLUOROCYCLOPROPYL)-N-(2-METHYL PHENYL)BENZAMIDE; PARTICULAR USE AGAINST ARTHROPODS, HELMINTHS AND MOLLUSCS; INSECTICIDES; ACARICIDES; NEMATICIDES; PHOTOSTABILITY; NONTOXIC TO MAMMALS HOECHST MARION ROUSSEL (FR) 2000-01-11 US disclosed
EP-0805795-A1 NOVEL AROMATIC AMIDES, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME, AND USE THEREOF AS PESTICIDES Hoechst Schering AgrEvo S.A. (FR) 1997-11-12 EP disclosed
WO-1996022965-A1 NOVEL AROMATIC AMIDES, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME, AND USE THEREOF AS PESTICIDES HOECHST SCHERING AGREVO S.A. (FR) 1996-08-01 WO disclosed