SCHEMBL5783604

SCHEMBL5783604

CC(=O)Nc1[c]ccc(N(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
RECQL P46063 1/20 0.38
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 2/20 0.36
TNIK Q9UKE5 1/20 0.35
KDM4E B2RXH2 2/20 0.34
HTT P42858 2/20 0.34
NPC1 O15118 1/20 0.34
GLA P06280 1/20 0.34
TNNI3 P19429 1/20 0.34
TNNT2 P45379 1/20 0.34
TNNC1 P63316 1/20 0.34
RUNX1 Q01196 1/20 0.34

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
SCHEMBL8720569 0.82 ALDH1A1 (0.43) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL4696811 0.80 HSD17B10 (0.47) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL11754501 0.77 ALDH1A1 (0.47) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL7841883 0.77 ALDH1A1 (0.47) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL197626 0.75 KDM4E (0.45) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL5782916 0.75 ALDH1A1 (0.42) NPSR1ALDH1A1MEN1KMT2APOLB
SCHEMBL7068909 0.75 ALDH1A1 (0.49) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL5782169 0.75 DYRK1A (0.43) MAPTALDH1A1LMNARAB9ASMN1; SMN2
SCHEMBL4328076 0.75 DYRK1A (0.43) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL6883224 0.72 HTT (0.46) MAPTALDH1A1MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1670794-A2 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS Amgen Inc. (US) 2006-06-21 EP disclosed
WO-2005033105-A2 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2005-04-14 WO disclosed
EP-0271893-B1 AZO COMPOUNDS CONTAINING CYANOGEN GROUPS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1991-05-29 EP disclosed
US-4889923-A AZO compounds containing cyano and vinyl-sulfone groups, a process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1989-12-26 US disclosed
EP-0271893-A2 Azo compounds containing cyanogen groups, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1988-06-22 EP disclosed
US-4119776-A Vinyl phthalide color formers NCR CORPORATION (US) 1978-10-10 US disclosed
US-4026883-A MACHINE READABLE AND COPIABLE NCR CORPORATION (US) 1977-05-31 US disclosed
US-4016174-A USED IN PRESSURE SENSITIVE RECORD MATERIALS AND MANIFOLD MARKING SYSTEMS NCR CORPORATION (US) 1977-04-05 US disclosed