SCHEMBL891063

SCHEMBL891063

COC(=O)c1cc2ccc(N(C)C)cc2c2c1C=CC(c1ccccc1)(c1ccc(N3CCCCC3)cc1)O2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRP6 O75581 1/20 0.33
NPC1 O15118 3/20 0.33
MAPT P10636 6/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
RAB9A P51151 3/20 0.33
AHR P35869 1/20 0.33
GFER P55789 1/20 0.33
AVPR2 P30518 1/20 0.32
HTR6 P50406 1/20 0.32
DHODH Q02127 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
AKT1 P31749 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL7473791 0.99 NPC1 (0.33) LRP6NPC1MAPTSMN1; SMN2RAB9A
SCHEMBL7483443 0.97 LRP6 (0.34) LRP6NPC1MAPTSMN1; SMN2RAB9A
SCHEMBL5650444 0.94 MAPT (0.38) LRP6NPC1MAPTSMN1; SMN2RAB9A
SCHEMBL5645606 0.93 MAPT (0.35) LRP6MAPTSMN1; SMN2RAB9ACYP2C9
SCHEMBL14823294 0.90 TP53 (0.35) NPC1MAPTSMN1; SMN2RAB9AMEN1
SCHEMBL7777302 0.89 DHODH (0.37) NPC1MAPTSMN1; SMN2RAB9AAHR
SCHEMBL13868624 0.89 KDM4E (0.35) NPC1MAPTSMN1; SMN2RAB9AMEN1
SCHEMBL13693075 0.89 MAPT (0.37) NPC1MAPTSMN1; SMN2RAB9ACYP2C19
SCHEMBL5549293 0.89 MAPT (0.39) NPC1MAPTSMN1; SMN2RAB9AAHR
SCHEMBL14302089 0.87 CNR2 (0.32) NPC1MAPTSMN1; SMN2RAB9AHTT

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118702667-A Photochromic dye compounds and their use in contact lenses for the correction of the red and green color blindness 重庆蕾明视光科技有限公司 2024-09-27 CN disclosed
CN-116836145-B Polymerizable photochromic compound and application thereof 重庆蕾明视光科技有限公司 2024-06-14 CN disclosed
CN-116836145-A Polymerizable photochromic compound and application thereof 重庆蕾明视光科技有限公司 2023-10-03 CN disclosed
US-11054558-B2 Photochromic articles containing a porous material with a photochromic dye and fluid, methods of making and using 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-07-06 US disclosed
US-11054558-B2 Photochromic articles containing a porous material with a photochromic dye and fluid, methods of making and using 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-07-06 US disclosed
US-20190324178-A1 PHOTOCHROMIC ARTICLES CONTAINING A POROUS MATERIAL WITH A PHOTOCHROMIC DYE AND FLUID, METHODS OF MAKING AND USING 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-10-24 US disclosed
US-20190324178-A1 PHOTOCHROMIC ARTICLES CONTAINING A POROUS MATERIAL WITH A PHOTOCHROMIC DYE AND FLUID, METHODS OF MAKING AND USING 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-10-24 US disclosed
US-8722076-B2 Photochrome- or near IR dye-coupled polymeric matrices for medical articles SURMODICS, INC. (US) 2014-05-13 US disclosed
US-8722076-B2 Photochrome- or near IR dye-coupled polymeric matrices for medical articles SURMODICS, INC. (US) 2014-05-13 US disclosed
US-8411347-B2 Composition comprising photochromic dyes in an ionic solvent ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2013-04-02 US disclosed
US-20120082713-A1 PHOTOCHROME- OR NEAR IR DYE-COUPLED POLYMERIC MATRICES FOR MEDICAL ARTICLES BANK OF MONTREAL, AS COLLATERAL AGENT 2012-04-05 US disclosed
US-20120082713-A1 PHOTOCHROME- OR NEAR IR DYE-COUPLED POLYMERIC MATRICES FOR MEDICAL ARTICLES BANK OF MONTREAL, AS COLLATERAL AGENT 2012-04-05 US disclosed
US-20120082713-A1 PHOTOCHROME- OR NEAR IR DYE-COUPLED POLYMERIC MATRICES FOR MEDICAL ARTICLES BANK OF MONTREAL, AS COLLATERAL AGENT 2012-04-05 US disclosed
EP-1410784-B1 Cosmetic composition comprising an oil phase and a naphthopyran dye and method OREAL (FR) 2007-02-07 EP disclosed
EP-1117656-B1 GREY COLOURING PHOTOCHROMIC FUSED PYRANS JAMES ROBINSON LTD (GB) 2002-05-29 EP disclosed
US-6387512-B1 FOR COLORING INKS, FUELS, PLASTICS OR GLASS JAMES ROBINSON LIMITED (GB) 2002-05-14 US 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-20120082713-A1 PHOTOCHROME- OR NEAR IR DYE-COUPLED POLYMERIC MATRICES FOR MEDICAL ARTICLES IK, PIR, PLOD1 LRP6 543/4885NPC1 4846/4885MAPT 836/4885

“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.