SCHEMBL8900086

SCHEMBL8900086

C=CCC(C)(C(=O)c1ccc(N2CCCCC2)cc1)N1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.44
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
ALDH1A1 P00352 6/20 0.41
MAPT P10636 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 3/20 0.41
TP53 P04637 2/20 0.41
TSHR P16473 2/20 0.41
ALOX15 P16050 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 1/20 0.41
STAT1 P42224 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ESR1 P03372 1/20 0.41
CTSL P07711 2/20 0.40
CTSB P07858 2/20 0.40
PTGS2 P35354 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL8898865 0.91 ALDH1A1 (0.44) HDAC6NPC1RAB9AALDH1A1MAPT
SCHEMBL8898770 0.86 GSK3B (0.47) HDAC6NPC1RAB9AALDH1A1MAPT
SCHEMBL8898370 0.86 NPC1 (0.46) HDAC6NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL2703962 0.85 ALDH1A1 (0.46) ALDH1A1HPGDTSHRLMNAHSD17B10
SCHEMBL8898829 0.82 SMN1; SMN2 (0.43) HDAC6NPC1RAB9AALDH1A1MAPT
SCHEMBL8898466 0.82 TP53 (0.40) HDAC6NPC1RAB9AALDH1A1MAPT
SCHEMBL9679922 0.79 NPC1 (0.53) HDAC6NPC1RAB9AALDH1A1MAPT
SCHEMBL9679544 0.77 MAPT (0.53) HDAC6NPC1RAB9AALDH1A1MAPT
SCHEMBL8899547 0.77 SMN1; SMN2 (0.40) HDAC6ALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL8898854 0.77 MAPK1 (0.47) NPC1RAB9AALDH1A1MAPTSMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5629356-A PHOTOCURABLE COMPOSITION CONTAINING ETHYLENICALLY UNSATURATED PHOTOPOLYMERIZABLE COMPOUND AND THE AMINOACETOPHENONE CIBA GEIGY CORPORATION (US) 1997-05-13 US disclosed
US-5554663-A α-aminoacetophenones as photoinitiators CIBA-GEIGY CORPORATION (US) 1996-09-10 US disclosed
US-5534629-A PHOTOPOLYMERIZATION OF PIGMENTED SYSTEMS, INKS CIBA-GEIGY CORPORATION (US) 1996-07-09 US disclosed
EP-0284561-B1 ALPHA-AMINOACETOPHENONES AS PHOTO INITIATORS CIBA-GEIGY AG (CH) 1993-05-12 EP disclosed
US-5077402-A For photocuring pigmented systems; printing inks, lacquers CIBA-GEIGY CORPORATION (US) 1991-12-31 US disclosed
EP-0284561-A2 Alpha-aminoacetophenones as photo initiators CIBA-GEIGY AG (CH) 1988-09-28 EP disclosed