SCHEMBL2495683

SCHEMBL2495683

CNc1ccc(C(c2ccc(NC)cc2)c2ccc(NC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
APP P05067 5/20 0.42
ALDH1A1 P00352 3/20 0.41
RECQL P46063 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CA12 O43570 2/20 0.41
CA2 P00918 2/20 0.41
CA1 P00915 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
HIF1A Q16665 1/20 0.41
ADRA2A P08913 2/20 0.39
ADRA2B P18089 2/20 0.39
ADRA2C P18825 2/20 0.39
KIF11 P52732 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL9321260 0.90 TSHR (0.59) TSHRAPPALDH1A1HSD17B10CYP3A4
SCHEMBL11317052 0.88 ALDH1A1 (0.59) TSHRAPPALDH1A1RECQLHSD17B10
SCHEMBL9627045 0.84 SLC2A1 (0.55) TSHRALDH1A1HSD17B10CA2CA1
SCHEMBL109651 0.84 SLC2A1 (0.55) TSHRALDH1A1HSD17B10CA2CA1
SCHEMBL153943 0.80 TSHR (0.67) TSHRAPPALDH1A1RECQLHSD17B10
SCHEMBL9320342 0.80 ESR1 (0.48) TSHRAPPALDH1A1RECQLHSD17B10
SCHEMBL170685 0.80 NFKB1 (0.47) TSHRAPPALDH1A1RECQLHSD17B10
SCHEMBL22415842 0.79 ALDH1A1 (0.49) TSHRALDH1A1RECQLCYP3A4THRB
SCHEMBL14162008 0.78 SLC2A1 (0.49) TSHRALDH1A1HSD17B10TP53CYP3A4
SCHEMBL10931824 0.78 MAPT (0.48) ALDH1A1CA12CA2CA1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111100237-B High-refractive-index alkaline water soluble resin, preparation method and high-refractive-index photoresist 无锡德贝尔光电材料有限公司 2022-03-11 CN claimed
CN-111100237-B High-refractive-index alkaline water soluble resin, preparation method and high-refractive-index photoresist 无锡德贝尔光电材料有限公司 2022-03-11 CN disclosed
CN-111100237-A High-refractive-index alkaline water soluble resin, preparation method and high-refractive-index photoresist 无锡德贝尔光电材料有限公司 2020-05-05 CN disclosed
EP-2380567-B1 MELANIN PRODUCTION INHIBITOR POLA CHEM IND INC (JP) 2019-01-16 EP disclosed
US-9593225-B2 Multifunctional porous aramids (aerogels), fabrication thereof, and catalytic compositions derived therefrom THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2017-03-14 US disclosed
US-9593225-B2 Multifunctional porous aramids (aerogels), fabrication thereof, and catalytic compositions derived therefrom THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2017-03-14 US disclosed
EP-3009123-A1 MELANIN PRODUCTION INHIBITOR Pola Chemical Industries Inc. (JP) 2016-04-20 EP disclosed
US-20160102187-A1 MULTIFUNCTIONAL POROUS ARAMIDS (AEROGELS), FABRICATION THEREOF, AND CATALYTIC COMPOSITIONS DERIVED THEREFROM THE CURATORS OF THE UNIVERSITY OF MISSOURI 2016-04-14 US disclosed
US-20160102187-A1 MULTIFUNCTIONAL POROUS ARAMIDS (AEROGELS), FABRICATION THEREOF, AND CATALYTIC COMPOSITIONS DERIVED THEREFROM THE CURATORS OF THE UNIVERSITY OF MISSOURI 2016-04-14 US disclosed
US-9260581-B2 Multifunctional porous aramids (aerogels) and fabrication thereof THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2016-02-16 US disclosed
EP-0058430-B1 DYESTUFF-CONTAINING MICROSCOPIC CAPSULE DISPERSION FOR RECORD MATERIALS MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-12-04 EP disclosed
US-4398753-A METHINE-TYPE DYES AND QUINONE DERIVATIVE IN REDOX SYSTEM FOR CARBON-FREE REPRODUCTION MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1983-08-16 US disclosed
US-4384871-A Dyestuff-containing microscopic capsule dispersion for record materials MITSUI TOATSU CHEMICALS, INC. (JP) 1983-05-24 US disclosed
EP-0058430-A1 Dyestuff-containing microscopic capsule dispersion for record materials MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-08-25 EP disclosed
EP-0055847-A1 Pressure sensitive recording unit MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-07-14 EP disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed
US-4139390-A Presensitized printing plate having a print-out image EASTMAN KODAK COMPANY (US) 1979-02-13 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-20160102187-A1 MULTIFUNCTIONAL POROUS ARAMIDS (AEROGELS), FABRICATION THEREOF, AND CATALYTIC COMPOSITIONS DERIVED THEREFROM PGM2, APEH, CD38 TSHR 4480/4885APP 2965/4885ALDH1A1 1931/4885

“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.