SCHEMBL10600119

SCHEMBL10600119

COc1ccc(-c2cc(-c3ccccc3)[o+]c(-c3ccccc3)c2)cc1.COc1ccc(-c2cc(-c3ccccc3)[o+]c(-c3ccccc3)c2)cc1.[O-]B([O-])F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.48
▸ RAB9A P51151 6/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MITF O75030 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ ABL1 P00519 2/20 0.46
▸ ABCB1 P08183 2/20 0.46
▸ BCR P11274 2/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ BACE1 P56817 2/20 0.42
▸ LTA4H P09960 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ SENP8 Q96LD8 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP6 Q9GZR1 1/20 0.41

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
SCHEMBL11045690 1.00 NPC1 (0.48) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL10601743 1.00 NPC1 (0.48) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL11050455 0.94 NPC1 (0.46) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL30489763 0.91 ABL1 (0.55) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL29968150 0.91 ABL1 (0.55) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL7913407 0.91 ABL1 (0.55) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL6686384 0.91 ABL1 (0.55) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL6685513 0.91 ABL1 (0.55) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL10582607 0.90 NPC1 (0.40) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL10601690 0.89 ABL1 (0.50) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1

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
EP-0196561-B1 PHOTOSENSITIVE LITHOGRAPHIC PRINTING PLATE NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-14 — — EP claimed
EP-0196561-A1 Photosensitive lithographic printing plate NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-10-08 — — EP claimed
EP-0196561-B1 PHOTOSENSITIVE LITHOGRAPHIC PRINTING PLATE NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-14 — — EP disclosed
EP-0196561-A1 Photosensitive lithographic printing plate NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-10-08 — — EP disclosed
US-4474868-A ORGANIC PEROXIDE AND COMPOUND CONTAINING CATIONIC OXYGEN, SULFUR OXYGEN,SULFUR OR SELENIUM NIPPON OIL AND FATS CO., LTD. (JP) 1984-10-02 — — US disclosed
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