SCHEMBL4029088

SCHEMBL4029088

O=c1nc(-c2ccccc2)oc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.58
NPC1 O15118 5/20 0.56
RAB9A P51151 5/20 0.56
HPGD P15428 5/20 0.49
CYP3A4 P08684 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
CA12 O43570 2/20 0.49
TP53 P04637 2/20 0.49
ABCB1 P08183 2/20 0.49
ADORA3 P0DMS8 2/20 0.49
AR P10275 2/20 0.49
CYP1B1 Q16678 2/20 0.49
CA9 Q16790 2/20 0.49
GABRP O00591 1/20 0.49
GABRD O14764 1/20 0.49
TNKS O95271 1/20 0.49
PARP1 P09874 1/20 0.49
CYP19A1 P11511 1/20 0.49

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
SCHEMBL30025603 1.00 ELANE (0.58) ELANENPC1RAB9AHPGDCYP3A4
SCHEMBL4028915 0.96 ELANE (0.54) ELANENPC1RAB9AHPGDCYP3A4
SCHEMBL812662 0.94 NPC1 (0.53) ELANENPC1RAB9AHPGDCYP3A4
SCHEMBL7576359 0.89 NPC1 (0.49) ELANENPC1RAB9AHPGDCYP3A4
SCHEMBL7869611 0.89 NPC1 (0.51) ELANENPC1RAB9AHPGDCYP3A4
SCHEMBL2882726 0.88 NPC1 (0.58) NPC1RAB9AHPGDCYP3A4SMN1; SMN2
SCHEMBL5774174 0.87 MAPK14 (0.48) ELANENPC1RAB9AHPGDCYP3A4
SCHEMBL5307520 0.86 TNKS (0.54) ELANENPC1RAB9AHPGDSMN1; SMN2
SCHEMBL3791447 0.86 NPC1 (0.63) ELANENPC1RAB9AHPGDSMN1; SMN2
SCHEMBL5307439 0.86 NPC1 (0.60) ELANENPC1RAB9AHPGDCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0693550-B1 Fabric bleaching composition CIBA SC HOLDING AG (CH) 2004-06-16 EP claimed
US-6528469-B2 Comprising a peroxy compound and an organomanganese compound as bleaching catalyst, such as manganese complexed with two phenol molecules which are joined by an amide, oxime, or imine-containing bridge CIBA SPECIALTY CHEMICALS CORPORATION 2003-03-04 US claimed
US-20010003737-A1 FABRIC BLEACHING COMPOSITION CIBA SPECIALTY CHEMICALS CORP. 2001-06-14 US claimed
US-6228127-B1 Bleaching or washing composition CIBA SPECIALTY CHEMICALS CORPORATION 2001-05-08 US claimed
EP-1021516-A1 FABRIC BLEACHING COMPOSITION Ciba Specialty Chemicals Holding Inc. (CH) 2000-07-26 EP claimed
EP-0876464-A1 BLEACHING OR WASHING COMPOSITION Ciba SC Holding AG (CH) 1998-11-11 EP claimed
WO-1997019162-A1 FABRIC BLEACHING COMPOSITION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-05-29 WO claimed
WO-1997014779-A1 BLEACHING OR WASHING COMPOSITION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-04-24 WO claimed
EP-0693550-A2 Fabric bleaching composition CIBA-GEIGY AG (CH) 1996-01-24 EP claimed
US-5286401-A Phenyl substituted benzoxazinones BASF AKTIENGESELLSCHAFT (DE) 1994-02-15 US claimed
US-20140213704-A1 NEW TRIAZINE DERIVATIVE AND ULTRAVIOLET ABSORBER FUJIFILM CORPORATION (JP) 2014-07-31 US disclosed
US-20140213704-A1 NEW TRIAZINE DERIVATIVE AND ULTRAVIOLET ABSORBER FUJIFILM CORPORATION (JP) 2014-07-31 US disclosed
EP-1213283-B1 Biphenyl-substituted triazines as light stabilisers CIBA HOLDING INC (CH) 2009-04-29 EP disclosed
US-6919454-B2 Biphenyl-substituted triazines CIBA SPECIALTY CHEMICALS CORP. (US) 2005-07-19 US disclosed
EP-0902021-B1 Cyclic polyamine salts CLARIANT GMBH (DE) 2005-07-06 EP disclosed
WO-1993022300-A1 PROCESS FOR THE PRODUCTION OF 2-PHENYL-BENZOXAZIN-4-ONE BP CHEMICALS LIMITED (GB) 1993-11-11 WO disclosed
EP-0502013-A1 USE OF HETEROCYCLIC COMPOUNDS AS BLEACH ACTIVATORS OR OPTICAL LIGHTENERS IN WASHING AND CLEANING AGENTS. BASF AG (DE) 1992-09-09 EP disclosed
EP-0482807-A1 Releasably encapsulated active substrates WARWICK INTERNATIONAL GROUP LIMITED (Co. n 2864019) (GB) 1992-04-29 EP disclosed
EP-0456109-A2 Process for producing granular bleaching activator composition BASF Aktiengesellschaft (DE) 1991-11-13 EP disclosed
WO-1991008279-A2 USE OF HETEROCYCLIC COMPOUNDS AS BLEACH ACTIVATORS OR OPTICAL LIGHTENERS IN WASHING AND CLEANING AGENTS BASF AKTIENGESELLSCHAFT (DE) 1991-06-13 WO 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 (1 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-20140213704-A1 NEW TRIAZINE DERIVATIVE AND ULTRAVIOLET ABSORBER XPA, CYP1B1, CYP1A1 ELANE 1113/4885NPC1 1287/4885RAB9A 2305/4885

“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.