SCHEMBL3687485

SCHEMBL3687485

Cc1cc(C(c2ccccc2)c2cc(C)c(N)c(C)c2)cc(C)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
CFTR P13569 1/20 0.38
GOPC Q9HD26 1/20 0.38
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
DPP4 P27487 2/20 0.37
F2 P00734 1/20 0.37
CYP1A1 P04798 1/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.36
GAA P10253 3/20 0.36
MGAM O43451 2/20 0.36

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
SCHEMBL28205472 1.00 ALDH1A1 (0.42) ALDH1A1CYP3A4TDP1TP53TSHR
SCHEMBL22129184 0.88 DPP4 (0.37) SLC6A2SLC6A4SLC6A3DPP4F2
SCHEMBL30075904 0.88 DPP4 (0.37) SLC6A2SLC6A4SLC6A3DPP4F2
SCHEMBL22044332 0.88 CYP3A4 (0.41) ALDH1A1CYP3A4TDP1TP53TSHR
SCHEMBL22044346 0.84 HTT (0.41) ALDH1A1SLC6A2SLC6A4SLC6A3CYP1A1
SCHEMBL22050675 0.83 ALDH1A1 (0.48) ALDH1A1CYP3A4TDP1TP53TSHR
SCHEMBL13523900 0.83 ALDH1A1 (0.43) ALDH1A1CYP3A4TDP1TP53TSHR
SCHEMBL13014493 0.82 MEN1 (0.38) ALDH1A1SLC6A2SLC6A4SLC6A3CYP2C9
SCHEMBL3688289 0.81 LMNA (0.42) ALDH1A1CYP3A4TDP1TP53TSHR
SCHEMBL14878840 0.80 CYP3A4 (0.35) ALDH1A1CYP3A4TDP1TP53TSHR

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
CN-118185008-A Polyimide film material containing shaft-joint type carbon dioxide affinity segment and synthesis method thereof 大连理工大学 2024-06-14 CN disclosed
CN-118185008-A Polyimide film material containing shaft-joint type carbon dioxide affinity segment and synthesis method thereof 大连理工大学 2024-06-14 CN disclosed
CN-115160154-A Preparation method of diamine monomer with side group containing isopropyl structure and polyimide polymer thereof 大连理工大学盘锦产业技术研究院 2022-10-11 CN disclosed
CN-115160154-A Preparation method of diamine monomer with side group containing isopropyl structure and polyimide polymer thereof 大连理工大学盘锦产业技术研究院 2022-10-11 CN disclosed
US-20200172470-A1 NOVEL (POLY)AMINE COMPOUND, RESIN AND CURED PRODUCT MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2020-06-04 US disclosed
EP-3659996-A1 NOVEL (POLY)AMINE COMPOUND, RESIN, AND CURED PRODUCT Mitsubishi Gas Chemical Company, Inc. (JP) 2020-06-03 EP disclosed
CN-108147969-A Triarylmethane type aromatic diamine compound, synthesis and its purification process 山东华夏神舟新材料有限公司 2018-06-12 CN disclosed
EP-2049599-B1 BASIC BISAZO COMPOUNDS ARCHROMA IP GMBH (CH) 2017-02-22 EP disclosed
CN-103897198-B A kind of polymer flooding crude oil demulsifier and preparation method thereof and application CHINA NATIONAL OFFSHORE OIL CORPORATION (CN) 2016-05-18 CN disclosed
CN-103881112-B A kind of produced water in polymer flooding water cleaning agent and preparation method thereof and application CHINA NATIONAL OFFSHORE OIL CORPORATION (CN) 2016-03-23 CN disclosed
EP-2251387-B1 Acidic azo dyes CLARIANT INT LTD (CH) 2012-02-29 EP disclosed
WO-2010130381-A1 ORGANIC COMPOUNDS CLARIANT INTERNATIONAL LTD (CH) 2010-11-18 WO disclosed
WO-2010130386-A1 ACIDIC AZO DYES CLARIANT INTERNATIONAL LTD (CH) 2010-11-18 WO disclosed
EP-2251387-A1 Acidic azo dyes Clariant International Ltd. (CH) 2010-11-17 EP disclosed
EP-2251383-A1 Organic compounds Clariant International Ltd. (CH) 2010-11-17 EP disclosed
US-7741240-B2 Transition metal compounds for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-06-22 US disclosed
US-20100000033-A1 Basic Bisazo Compounds CLARIANT FINANCE (BVI) LIMITED (VG) 2010-01-07 US disclosed
US-20100000033-A1 Basic Bisazo Compounds CLARIANT FINANCE (BVI) LIMITED (VG) 2010-01-07 US disclosed
US-20080033125-A1 Transition Metal Compounds for Olefin Polymerization and Oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2008-02-07 US disclosed
WO-2008012322-A1 BASIC BISAZO COMPOUNDS CLARIANT INTERNATIONAL LTD (CH) 2008-01-31 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-20200172470-A1 NOVEL (POLY)AMINE COMPOUND, RESIN AND CURED PRODUCT PAM, CBR1, KDM1A ALDH1A1 276/4885CYP3A4 1300/4885TDP1 2589/4885

“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.