SCHEMBL105385

SCHEMBL105385

Cc1cc(N)c(O)c(-n2nc3ccccc3n2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.68
RAB9A P51151 11/20 0.68
LMNA P02545 2/20 0.59
POLB P06746 2/20 0.59
MAPT P10636 10/20 0.47
ALDH1A1 P00352 9/20 0.47
KDM4E B2RXH2 8/20 0.47
GAA P10253 3/20 0.47
SMN1; SMN2 Q16637 8/20 0.47
HPGD P15428 6/20 0.41
MEN1 O00255 3/20 0.41
CASP1 P29466 3/20 0.41
KMT2A Q03164 3/20 0.41
HSD17B10 Q99714 3/20 0.41
ALOX15 P16050 2/20 0.41
USP2 O75604 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL110113 0.83 NPC1 (0.71) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL1275936 0.83 NPC1 (0.71) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL7703339 0.83 NPC1 (0.71) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL29489567 0.83 NPC1 (0.71) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL4342952 0.83 NPC1 (0.50) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL18375849 0.81 NPC1 (0.68) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL9408736 0.81 NPC1 (0.68) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL10598824 0.81 NPC1 (1.00) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL6929698 0.80 NPC1 (0.48) NPC1RAB9ALMNAPOLBMAPT
SCHEMBL20365735 0.80 NPC1 (0.62) NPC1RAB9ALMNAPOLBMAPT

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11292859-A None JP disclosed
JP-11292858-A None JP disclosed
JP-11349575-A None JP disclosed
US-11078419-B2 Substituted benzotriazole phenolate salts and antioxidant compositions formed therefrom 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-08-03 US disclosed
US-11053373-B2 Polymeric matrices with ionic additives 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-07-06 US disclosed
US-10724171-B2 Electret webs with charge-enhancing additives 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-07-28 US disclosed
US-20200172809-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM 3M INNOVATIVE PROPERTIES CO (US) 2020-06-04 US disclosed
US-10669481-B2 Substituted benzotriazole phenolate salts and antioxidant compositions formed therefrom 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-06-02 US disclosed
US-20190003112-A1 ELECTRET WEBS WITH CHARGE-ENHANCING ADDITIVES 3M INNOVATIVE PROPERTIES COMPANY 2019-01-03 US disclosed
US-20180195000-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM 3M INNOVATIVE PROPERTIES COMPANY 2018-07-12 US disclosed
US-6517742-B1 2-(butyl 4'-ylaminobenzoate)-4,6-bis((1,3,3,3-tetramethyl-1 -((trimethylsilyl)oxy)disiloxanyl)propyl-3-ylamino)-s-triazine; s-triazine derivatives substituted by at least one silicone group; from cyanuric chloride L'OREAL (FR) 2003-02-11 US disclosed
US-6361764-B2 ULTRAVIOLET LIGHT SCREENING AGENTS; COSMETICS SOCIETE L'OREAL S.A. (FR) 2002-03-26 US disclosed
US-20020010179-A1 Novel insoluble S-triazine derivatives, process for their preparation, compositions containing them and uses thereof RICHARD HERVE (FR) 2002-01-24 US disclosed
JP-H11349575-A 2H-BENZOTRIAZOLE DERIVATIVE, ITS PRODUCTION AND USE CHEMIPROKASEI KAISHA LTD 1999-12-21 JP disclosed
JP-H11292859-A 2H-BENZOTRIAZOLE DERIVATIVE AND ITS PRODUCTION AND USE CHEMIPROKASEI KAISHA LTD 1999-10-26 JP disclosed
JP-H11292858-A 2H-BENZOTRIAZOLE DERIVATIVE AND ITS PRODUCTION AND USE CHEMIPROKASEI KAISHA LTD 1999-10-26 JP disclosed
EP-0944624-A1 INSOLUBLE S-TRIAZINE DERIVATIVES AND THEIR USE AS UV FILTERS L'OREAL (FR) 1999-09-29 EP disclosed
EP-0841341-B1 Sunscreen agents, and cosmetic compositions containing them OREAL (FR) 1999-04-07 EP disclosed
WO-1998025922-A1 INSOLUBLE S-TRIAZINE DERIVATIVES AND THEIR USE AS UV FILTERS L'OREAL (FR) 1998-06-18 WO disclosed
EP-0841341-A1 Sunscreen agents, and cosmetic compositions containing them L'OREAL (FR) 1998-05-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020010179-A1 Novel insoluble S-triazine derivatives, process for their preparation, compositions containing them and uses thereof TST, TYR, TPST2 NPC1 3874/4885RAB9A 4784/4885LMNA 2677/4885
US-20200172809-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM COMT, OGFOD1, TYR NPC1 4227/4885RAB9A 4875/4885LMNA 3383/4885
US-10669481-B2 Substituted benzotriazole phenolate salts and antioxidant compositions formed therefrom COMT, OGFOD1, TYR NPC1 4227/4885RAB9A 4875/4885LMNA 3383/4885
US-11078419-B2 Substituted benzotriazole phenolate salts and antioxidant compositions formed therefrom COMT, OGFOD1, TYR NPC1 4227/4885RAB9A 4875/4885LMNA 3383/4885
US-20180195000-A1 SUBSTITUTED BENZOTRIAZOLE PHENOLATE SALTS AND ANTIOXIDANT COMPOSITIONS FORMED THEREFROM COMT, OGFOD1, TYR NPC1 4227/4885RAB9A 4875/4885LMNA 3383/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.