SCHEMBL6028201

SCHEMBL6028201

CC(C)(C)c1cccc(N)c1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.48
CA2 P00918 1/20 0.48
CYP3A4 P08684 5/20 0.42
TSHR P16473 4/20 0.42
PIK3CA P42336 1/20 0.42
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
ALDH1A1 P00352 7/20 0.41
TDP1 Q9NUW8 4/20 0.41
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KIF11 P52732 1/20 0.35
ALOX12 P18054 1/20 0.34
NSD2 O96028 2/20 0.32
KEAP1 Q14145 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL138254 0.87 CA2 (0.55) CD44CA2CYP3A4TSHRPIK3CA
SCHEMBL8512559 0.85 CD44 (0.48) CD44CA2CYP3A4TSHRPIK3CA
SCHEMBL2020228 0.79 CD44 (0.43) CD44CA2CYP3A4TSHRPIK3CA
SCHEMBL70170 0.79 TSHR (0.50) CA2CYP3A4TSHRPIK3CAGABRA1
SCHEMBL30154643 0.78 GABRA1 (0.56) CD44CA2CYP3A4TSHRPIK3CA
SCHEMBL1804107 0.78 GABRA1 (0.56) CD44CA2CYP3A4TSHRPIK3CA
SCHEMBL2056782 0.78 CA2 (0.46) CD44CA2CYP3A4TSHRPIK3CA
SCHEMBL5163816 0.78 CYP3A4 (0.59) CD44CA2CYP3A4TSHRPIK3CA
SCHEMBL29919506 0.78 CD44 (0.41) CD44CA2CYP3A4TSHRPIK3CA
SCHEMBL28888577 0.77 CD44 (0.44) CD44CYP3A4TSHRPIK3CAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116063238-A Java oxine compound and preparation method thereof 上海交通大学 2023-05-05 CN claimed
CN-115974796-A Woxine medicinal molecule and preparation method thereof 上海交通大学 2023-04-18 CN claimed
US-4992527-A Heat resistance, protective coatings, electronics AMOCO CORPORATION (US) 1991-02-12 US claimed
US-4973659-A HEAR RESISTANT FILMS, FIBERS, COMPOSITES AMOCO CORPORATION (US) 1990-11-27 US claimed
US-4968780-A SOLUBLE IN N-METHYLPYRROLIDONE, HIGH GLASS TRANSITION TEMPERATURE, HEAT RESISTANT FILMS, FIBERS AND COMPOSITES AMOCO CORPORATION (US) 1990-11-06 US claimed
EP-0219709-B1 POLYMETHYLENE POLYPHENYLAMINE MODIFIED DIAMINE CHAIN EXTENDERS AND POLYUREA ELASTOMERS THEREFROM THE DOW CHEMICAL COMPANY (US) 1989-11-23 EP claimed
EP-0219709-A2 Polymethylene polyphenylamine modified diamine chain extenders and polyurea elastomers therefrom THE DOW CHEMICAL COMPANY (US) 1987-04-29 EP claimed
EP-0153606-A2 Process for the production of polyurethane urea elastomers AIR PRODUCTS AND CHEMICALS, INC. (US) 1985-09-04 EP claimed
US-4482690-A AROMATIC DIAMINE AS CHAIN EXTENDER AIR PRODUCTS AND CHEMICALS, INC. (US) 1984-11-13 US claimed
CN-118359811-A Soluble polyimide and method for preparing epoxy resin composite material by using same 安徽大学 2024-07-19 CN disclosed
US-11932635-B2 CRBN ligands and uses thereof KYMERA THERAPEUTICS, INC. (US) 2024-03-19 US disclosed
US-20230234950-A1 CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-27 US disclosed
CN-116063238-A Java oxine compound and preparation method thereof 上海交通大学 2023-05-05 CN disclosed
CN-115974796-A Woxine medicinal molecule and preparation method thereof 上海交通大学 2023-04-18 CN disclosed
EP-0153606-A3 PROCESS FOR THE PRODUCTION OF POLYURETHANE UREA ELASTOMERS AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-02-04 EP disclosed
EP-0178583-A1 Polyurethane systems using monotertiary-alkyltoluenediamine as a cross linker AIR PRODUCTS AND CHEMICALS, INC. (US) 1986-04-23 EP disclosed
EP-0153606-A2 Process for the production of polyurethane urea elastomers AIR PRODUCTS AND CHEMICALS, INC. (US) 1985-09-04 EP disclosed
EP-0153606-A2 Process for the production of polyurethane urea elastomers AIR PRODUCTS AND CHEMICALS, INC. (US) 1985-09-04 EP disclosed
US-4482690-A AROMATIC DIAMINE AS CHAIN EXTENDER AIR PRODUCTS AND CHEMICALS, INC. (US) 1984-11-13 US disclosed
US-4482690-A AROMATIC DIAMINE AS CHAIN EXTENDER AIR PRODUCTS AND CHEMICALS, INC. (US) 1984-11-13 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 (2 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-20230234950-A1 CRBN LIGANDS AND USES THEREOF CRBN, CRKL, ERBB3 CD44 1646/4885CA2 3842/4885CYP3A4 4566/4885
US-11932635-B2 CRBN ligands and uses thereof CRBN, CRKL, ERBB3 CD44 1646/4885CA2 3842/4885CYP3A4 4566/4885

“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.