SCHEMBL9680508

SCHEMBL9680508

CC(C)(C(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.60
▸ RAB9A P51151 5/20 0.60
▸ ALDH1A1 P00352 4/20 0.60
▸ L3MBTL1 Q9Y468 2/20 0.60
▸ GAA P10253 2/20 0.60
▸ TTR P02766 1/20 0.50
▸ HPGD P15428 1/20 0.48
▸ ATM Q13315 2/20 0.47
▸ PTPRC P08575 3/20 0.45
▸ CDC25A P30304 1/20 0.44
▸ CDC25B P30305 1/20 0.44
▸ S100A4 P26447 1/20 0.44
▸ CASP3 P42574 2/20 0.43
▸ SENP8 Q96LD8 2/20 0.43
▸ SENP7 Q9BQF6 2/20 0.43
▸ SENP6 Q9GZR1 2/20 0.43
▸ PLA2G1B P04054 1/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ NFKB2 Q00653 1/20 0.43
▸ RELA Q04206 1/20 0.43

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
SCHEMBL10946337 0.99 NPC1 (0.59) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL9680419 0.99 NPC1 (0.63) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL10943943 0.96 ALDH1A1 (0.54) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL10944726 0.94 ALDH1A1 (0.52) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL10948642 0.93 ALDH1A1 (0.54) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL9679962 0.86 HPGD (0.62) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL10947824 0.86 L3MBTL1 (0.45) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL9680435 0.86 SRD5A1 (0.48) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL9680476 0.85 HPGD (0.64) NPC1RAB9AALDH1A1L3MBTL1GAA
SCHEMBL10942591 0.85 HPGD (0.61) NPC1RAB9AALDH1A1L3MBTL1GAA

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-5145885-A Morpholine compound, binders CIBA-GEIGY CORPORATION (US) 1992-09-08 — — US disclosed
US-4992547-A Aminoaryl ketone photoinitiators CIBA-GEIGY CORPORATION (US) 1991-02-12 — — US disclosed
EP-0138754-B1 PHOTOCURABLE COMPOSITIONS CIBA-GEIGY AG (CH) 1988-05-25 — — EP disclosed
US-4496447-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1985-01-29 — — US disclosed
US-4374984-A Aromatic-aliphatic ketones useful as photoinitiators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-02-22 — — US disclosed
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