SCHEMBL3729178

SCHEMBL3729178

CCOc1cc(C(=O)Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.52
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 5/20 0.46
LMNA P02545 4/20 0.46
ALOX12 P18054 1/20 0.46
POLB P06746 2/20 0.46
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
AKR1C1 Q04828 1/20 0.46
MYC P01106 1/20 0.46
MAX P61244 1/20 0.46
HTT P42858 1/20 0.45
AR P10275 1/20 0.45

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
SCHEMBL22660910 0.89 AKR1C3 (0.52) MAPTALDH1A1LMNAMEN1NPC1
SCHEMBL29682151 0.88 GAA (0.62) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL11691516 0.88 GAA (0.62) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL22660921 0.87 AKR1C3 (0.59) MAPTALDH1A1LMNAPOLBKMT2A
SCHEMBL3537490 0.87 MAPT (0.62) MAPTGAALMNAPOLBAKR1C3
SCHEMBL13318974 0.87 POLB (0.59) MAPTGAASMN1; SMN2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL3729179 0.85 MAPT (0.60) MAPTGAAPOLBAKR1C3AKR1C2
SCHEMBL1935497 0.85 MAPK1 (0.60) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL16960732 0.85 MAPT (0.55) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL221362 0.84 AR (0.61) MAPTGAASMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114945636-B Azo compound or salt thereof, polarizing film, polarizing plate, and display device 日本化药株式会社 2024-07-12 CN disclosed
CN-116261924-A Polarizing element, polarizing plate, and display device provided with same 日本化药株式会社 2023-06-13 CN disclosed
CN-114945636-A Azo compound or salt thereof, and dye-based polarizing film, dye-based polarizing plate, and display device containing the same 日本化药株式会社 2022-08-26 CN disclosed
CN-111433290-B Azo compound or salt thereof, and polarizing element, polarizing plate and display device each comprising the same 日本化药株式会社 2022-06-14 CN disclosed
WO-2022071201-A1 POLARIZING ELEMENT, POLARIZING PLATE, AND DISPLAY DEVICE PROVIDED WITH SAME 日本化薬株式会社 2022-04-07 WO disclosed
CN-113795554-A Achromatic polarizing element, and achromatic polarizing plate and display device using same 日本化药株式会社 2021-12-14 CN disclosed
WO-2021153374-A1 AZO COMPOUND OR SALT THEREOF, AND DYE-BASED POLARIZING FILM, DYE-BASED POLARIZING PLATE AND DISPLAY DEVICE EACH CONTAINING SAME 日本化薬株式会社 2021-08-05 WO disclosed
WO-2020230647-A1 ACHROMATIC POLARIZER, ACHROMATIC POLARIZING PLATE USING SAME, AND DISPLAY DEVICE 日本化薬株式会社 2020-11-19 WO disclosed
CN-111433290-A Azo compound or salt thereof, and polarizing element, polarizing plate and display device each containing the same 日本化药株式会社 2020-07-17 CN disclosed
US-20100158996-A1 ESTER COMPOUND AND MEDICAL USE THEREOF JAPAN TOBACCO INC. 2010-06-24 US disclosed
US-7625948-B2 Ester compound and medicinal use thereof JAPAN TOBACCO INC. (JP) 2009-12-01 US disclosed
US-7625948-B2 Ester compound and medicinal use thereof JAPAN TOBACCO INC. (JP) 2009-12-01 US disclosed
US-7432392-B2 Ester derivatives and medical use thereof JAPAN TOBACCO INC. (JP) 2008-10-07 US disclosed
US-7432392-B2 Ester derivatives and medical use thereof JAPAN TOBACCO INC. (JP) 2008-10-07 US disclosed
US-7432392-B2 Ester derivatives and medical use thereof JAPAN TOBACCO INC. (JP) 2008-10-07 US disclosed
US-20060205726-A1 Ester derivatives and medical use thereof JAPAN TOBACCO INC. (JP) 2006-09-14 US disclosed
EP-1669345-A1 ESTER DERIVATIVE AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2006-06-14 EP disclosed
US-20050075367-A1 Ester compound and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-04-07 US disclosed
EP-1479666-A1 ESTER COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-11-24 EP disclosed
US-4052444-A DIAZO COUPLERS FOR MONOAZO DYES HOECHST AKTIENGESELLSCHAFT (DT) 1977-10-04 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 (3 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-20060205726-A1 Ester derivatives and medical use thereof MTTP, LIPC, CETP MAPT 3711/4885GAA 237/4885SMN1; SMN2 4460/4885
US-20050075367-A1 Ester compound and medicinal use thereof LIPC, CES1, MTTP MAPT 4387/4885GAA 2055/4885SMN1; SMN2 4775/4885
US-20100158996-A1 ESTER COMPOUND AND MEDICAL USE THEREOF LIPC, CES1, MTTP MAPT 4163/4885GAA 1962/4885SMN1; SMN2 4782/4885

“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.