SCHEMBL166558

SCHEMBL166558

N#Cc1ccc(Cl)cc1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
CYP3A4 P08684 4/20 0.52
ALOX15 P16050 3/20 0.52
ALDH1A1 P00352 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
TP53 P04637 1/20 0.50
VCAM1 P19320 1/20 0.48
HPGD P15428 3/20 0.46
ALOX12 P18054 2/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MAOA P21397 2/20 0.46
MAOB P27338 2/20 0.46
KDM4E B2RXH2 3/20 0.44
MAPT P10636 3/20 0.44
GAA P10253 2/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
CYP2A6 P11509 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
Ammonia Solution, Strong SCHEMBL28847255 0.98 TSHR (0.50) TSHRCYP3A4ALOX15ALDH1A1SMN1; SMN2
SCHEMBL164458 0.82 TSHR (0.52) TSHRCYP3A4ALOX15ALDH1A1SMN1; SMN2
SCHEMBL29462390 0.82 TSHR (0.52) TSHRCYP3A4ALOX15ALDH1A1SMN1; SMN2
SCHEMBL7050401 0.78 MAOA (0.61) CYP3A4ALDH1A1TDP1VCAM1HPGD
SCHEMBL31441456 0.78 MAOA (0.61) CYP3A4ALDH1A1TDP1VCAM1HPGD
SCHEMBL29137848 0.77 TSHR (0.52) TSHRCYP3A4ALOX15ALDH1A1SMN1; SMN2
SCHEMBL6146245 0.77 TSHR (0.52) TSHRCYP3A4ALOX15ALDH1A1SMN1; SMN2
SCHEMBL2028221 0.76 KDM4E (0.55) TSHRCYP3A4ALDH1A1SMN1; SMN2TDP1
SCHEMBL5070146 0.76 MEN1 (0.48) TSHRCYP3A4ALOX15ALDH1A1SMN1; SMN2
SCHEMBL30799696 0.76 KDM4E (0.55) TSHRCYP3A4ALDH1A1SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119176746-B Method for preparing bisphenol A and heterocyclic compound by using waste PC 浙江大学 2025-05-30 CN claimed
CN-119176746-A Method for preparing bisphenol A and heterocyclic compound by using waste PC 浙江大学 2024-12-24 CN claimed
CN-118440013-A Preparation method of quinazoline diketone compound 安顺学院 2024-08-06 CN claimed
CN-114380718-B Acylation method of aniline compound 河南农业大学 2022-09-30 CN claimed
CN-114380718-A Acylation method of aniline compound 河南农业大学 2022-04-22 CN claimed
CN-109232366-B Preparation method and application of 2-acyl-3-aminoindole compound 华中师范大学 2020-08-21 CN claimed
CN-106946800-B A kind of synthetic method of -2,4 (1H, 3H)-diketone of quinazoline and its derivative 华东师范大学 2019-11-15 CN claimed
CN-109232366-A The preparation method and applications of 2- acyl group -3- amino indole class compound 华中师范大学 2019-01-18 CN claimed
CN-106946800-A A kind of synthetic method of (1H, the 3H) diketone of quinazoline 2,4 and its derivative 华东师范大学 2017-07-14 CN claimed
US-7759390-B2 chemokine receptor 9(CCR9) antagonists such as, 5-Chloro-thiophene-2-sulfonic acid (4-cyano-2-methyl-phenyl)-amide, used for treating autimmune and inflammatory diseases, transplantat rejection and cancer NOVARTIS AG (CH) 2010-07-20 US claimed
US-7547713-B2 O-pyridinequinone derivatives, the composition containing the derivatives, the process for preparation of the derivatives and the use of the derivatives GU LIANQUAN 2009-06-16 US claimed
US-20080300295-A1 Inhibitors of Ccr9 Activity NOVARTIS AG (CH) 2008-12-04 US claimed
EP-1966182-A1 INHIBITORS OF CCR9 ACTIVITY Novartis AG (CH) 2008-09-10 EP claimed
WO-2007071440-A1 INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2007-06-28 WO claimed
US-20060111405-A1 O-pyridinequinone derivatives, the composition containing the derivatives, the process for preparation of the derivatives and the use of the derivatives GU LIANQUAN 2006-05-25 US claimed
US-4288362-A Monoazo pigments containing a quinazo linonylacetoacetanilide coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-09-08 US claimed
US-12552772-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2026-02-17 US disclosed
US-12540248-B2 Metal surface-treating agent, and metal material with coating film and method for manufacturing same NIHON PARKERIZING CO., LTD. (JP) 2026-02-03 US disclosed
US-3987192-A ANTIALLERGENS AND ANTIANAPHYLAXID; 2'-CYANO-OXANILIC ACID THE UPJOHN COMPANY (US) 1976-10-19 US disclosed
US-3956264-A Basic azo dyestuffs having indolyl-methyleneamino substituent in the diazo component BAYER AKTIENGESELLSCHAFT (DT) 1976-05-11 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 (4 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-12540248-B2 Metal surface-treating agent, and metal material with coating film and method for manufacturing same VMA21, CARM1, CROCC TSHR 1756/4885CYP3A4 3843/4885ALOX15 2760/4885
US-20060111405-A1 O-pyridinequinone derivatives, the composition containing the derivatives, the process for preparation of the derivatives and the use of the derivatives PTGS2, PTGES2, PTGES TSHR 4772/4885CYP3A4 32/4885ALOX15 227/4885
US-20080300295-A1 Inhibitors of Ccr9 Activity CCR9, CCR1, CCR4 TSHR 1137/4885CYP3A4 842/4885ALOX15 2570/4885
US-12552772-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD YAP1, TEAD3, TEAD2 TSHR 1671/4885CYP3A4 3463/4885ALOX15 3142/4885

“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.