SCHEMBL1011046

SCHEMBL1011046

Cc1ccccc1Nc1ccc2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
CYP3A4 P08684 2/20 0.57
HSD17B10 Q99714 2/20 0.57
HPGD P15428 2/20 0.57
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
MAPK14 Q16539 2/20 0.48
MAPK13 O15264 1/20 0.48
MAPK12 P53778 1/20 0.48
MAPK11 Q15759 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HIF1A Q16665 1/20 0.47
EPHX2 P34913 1/20 0.45
IMPDH2 P12268 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL15273014 0.87 ALDH1A1 (0.52) ALDH1A1CYP3A4HSD17B10HPGDNPC1
SCHEMBL17794436 0.86 ALDH1A1 (0.59) ALDH1A1CYP3A4HSD17B10HPGDNPC1
SCHEMBL29688279 0.86 ALDH1A1 (0.68) ALDH1A1CYP3A4HSD17B10HPGDNPC1
SCHEMBL1923372 0.86 ALDH1A1 (0.68) ALDH1A1CYP3A4HSD17B10HPGDNPC1
SCHEMBL4171886 0.84 CYP2A6 (0.53) ALDH1A1CYP3A4HSD17B10HPGDNPC1
SCHEMBL6696006 0.82 ALDH1A1 (0.59) ALDH1A1CYP3A4HSD17B10HPGDNPC1
SCHEMBL28727267 0.82 RAPGEF4 (0.49) ALDH1A1CYP3A4HSD17B10HPGDNPC1
SCHEMBL29653984 0.81 MAPT (0.54) ALDH1A1HSD17B10HPGDNPC1RAB9A
SCHEMBL108882 0.81 MAPT (0.54) ALDH1A1HSD17B10HPGDNPC1RAB9A
SCHEMBL11565382 0.81 ALDH1A1 (0.57) ALDH1A1CYP3A4HSD17B10HPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5736070-A COMPRISING A TITANATE OR ZIRCONATE-COATED COPPER POWDER, A RESOLE BINDER, A CHELATING AGENT TO PREVENT OXIDATION, AN ADHESION IMPROVER AND A CONDUCTIVITY IMPROVER TATSUTA ELECTRIC WIRE AND CABLE CO., LTD. (JP) 1998-04-07 US claimed
CN-117659245-B Linear medium-low density vinyl polymer with polar groups 中国石油天然气股份有限公司 2026-05-15 CN disclosed
CN-117659245-A Linear medium-low density vinyl polymer with polar groups 中国石油天然气股份有限公司 2024-03-08 CN disclosed
EP-4002509-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2022-05-25 EP disclosed
US-9991452-B2 Condensed-cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-05 US disclosed
US-9991452-B2 Condensed-cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-05 US disclosed
US-20160190448-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190448-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190448-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 US disclosed
CN-102015671-B Paper sizing additives, their preparation process, and their use AKZO NOBEL NV 2013-09-11 CN disclosed
US-5736070-A COMPRISING A TITANATE OR ZIRCONATE-COATED COPPER POWDER, A RESOLE BINDER, A CHELATING AGENT TO PREVENT OXIDATION, AN ADHESION IMPROVER AND A CONDUCTIVITY IMPROVER TATSUTA ELECTRIC WIRE AND CABLE CO., LTD. (JP) 1998-04-07 US disclosed
US-4985159-A Alkenylated toluenediamines as antioxidants for organic materials AIR PRODUCTS AND CHEMICALS, INC. (US) 1991-01-15 US disclosed
EP-0272651-A2 N-tert-butyl derivatives of toluenediamine and mixtures as antioxidant for organic materials AIR PRODUCTS AND CHEMICALS, INC. (US) 1988-06-29 EP disclosed
EP-0270031-A2 Tertiary butyl derivatives of toluenediamine and mixtures as antioxidant for organic materials AIR PRODUCTS AND CHEMICALS, INC. (US) 1988-06-08 EP disclosed
US-4711737-A FOR HYDROCARBON OILS, RUBBER AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-12-08 US disclosed
US-4693837-A Tertiary butyl derivatives of toluenediamine and mixtures as antioxidant for organic materials AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-09-15 US disclosed
EP-0017908-B1 A METHOD FOR DETERMINING THE PRESENCE IN A SAMPLE OF AN ANALYTE AND A KIT FOR USE IN THIS METHOD SYVA COMPANY (US) 1986-08-20 EP disclosed
US-4026859-A AROMATIZATION CATALYST HERCULES INCORPORATED (US) 1977-05-31 US disclosed
US-4026860-A AROMATIZATION CATALYST HERCULES INCORPORATED (US) 1977-05-31 US disclosed
US-4026861-A AROMATIZATION CATALYST HERCULES INCORPORATED (US) 1977-05-31 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-20160190448-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CCNT1, CCNE2, CRY1 ALDH1A1 520/4885CYP3A4 1162/4885HSD17B10 2136/4885

“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.