SCHEMBL1965758

SCHEMBL1965758

COc1nc(C)nc(Cl)n1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.45
GAA P10253 2/20 0.40
ALDH1A1 P00352 3/20 0.33
TSHR P16473 2/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 2/20 0.32
HSP90AA1 P07900 1/20 0.32
MAPT P10636 3/20 0.31
PIK3CA P42336 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
ATM Q13315 2/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL9529398 0.98 CYP1A2 (0.44) CYP1A2GAAALDH1A1TSHRALOX15
Methylene Chloride SCHEMBL28551225 0.93 CYP1A2 (0.41) CYP1A2GAAALDH1A1HTTPIK3CA
SCHEMBL329417 0.84 CYP1A2 (0.52) CYP1A2GAAALDH1A1TSHRALOX15
SCHEMBL8795 0.84 CYP1A2 (0.52) CYP1A2GAAALDH1A1TSHRALOX15
SCHEMBL8844371 0.81 GAA (0.47) CYP1A2GAAALDH1A1TSHRHTT
SCHEMBL1131131 0.81 GAA (0.47) CYP1A2GAAALDH1A1TSHRHTT
SCHEMBL9433260 0.75 POLB (0.40) CYP1A2ALDH1A1TSHRMAPTSMN1; SMN2
SCHEMBL12393233 0.74 TSHR (0.35) TSHR
SCHEMBL94294 0.74
SCHEMBL802854 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112694447-A Synthesis method of N-methyl triazine 营口昌成新材料科技有限公司 2021-04-23 CN claimed
US-11840545-B1 Spirooxindole-copper complex as novel efficient anticorrosion agent for C-steel King Faisal University (SA) 2023-12-12 US disclosed
US-20230219983-A1 TETRADENTATE DIAMINODIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX, AND METHOD FOR MANUFACTURING SAME AND APPLICATION FOR SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2023-07-13 US disclosed
US-11639362-B2 Tetradentate diaminodiphosphine ligand and transition metal complex, and method for manufacturing same and application for same TAKASAGO INTERNATIONAL CORPORATION (JP) 2023-05-02 US disclosed
US-20220047724-A1 NOVEL TRICARBOCYANINE-CYCLODEXTRIN(S) CONJUGATES AND USE THEREOF CYANAGEN S R L (IT) 2022-02-17 US disclosed
US-11179481-B2 Tricarbocyanine-cyclodextrin(s) conjugates and use thereof CYANAGEN S.R.L. (IT) 2021-11-23 US disclosed
CN-112694447-A Synthesis method of N-methyl triazine 营口昌成新材料科技有限公司 2021-04-23 CN disclosed
CN-112694447-A Synthesis method of N-methyl triazine 营口昌成新材料科技有限公司 2021-04-23 CN disclosed
US-10441666-B2 Tricarbocyanine-cyclodextrin(s) conjugates and use thereof CYANAGEN S.R.L. (IT) 2019-10-15 US disclosed
US-9853228-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-26 US disclosed
US-5186734-A HERBICIDAL BISAZINYL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1993-02-16 US disclosed
US-5151514-A Triazine substituted herbicides BAYER AKTIENGESELLSCHAFT (DE) 1992-09-29 US disclosed
WO-1992014715-A1 SULFONYL UREA DERIVATES, METHOD FOR PREPARING THEM AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 1992-09-03 WO disclosed
US-5142060-A Herbicidal substituted 4-sulphonylamino-2-azinyl-1,2,4-triazol-3-ones BAYER AKTIENGESELLSCHAFT (DE) 1992-08-25 US disclosed
EP-0477637-A1 Bisazinylic compounds BAYER AG (DE) 1992-04-01 EP disclosed
US-5095113-A Preparation of methyl-1,3-5-triazines E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-03-10 US disclosed
US-5089627-A Chemical intermediates therefor BAYER AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-5085687-A HERBICIDAL SUBSTITUTED 4-SULPHONYLAMINO-2-AZINYL-1,2,4-TRIAZOL-3-ONES BAYER AKTIENGESELLSCHAFT (DE) 1992-02-04 US disclosed
US-4988381-A HERBICIDES, PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1991-01-29 US disclosed
EP-0384244-A1 Sulfonylimino-azinyl heteroazoles, method and intermediates for their preparation and their use as herbicides BAYER AG (DE) 1990-08-29 EP 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 (6 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-10441666-B2 Tricarbocyanine-cyclodextrin(s) conjugates and use thereof KRTCAP2, DSC1, TBCD CYP1A2 3832/4885GAA 244/4885ALDH1A1 2927/4885
US-20230219983-A1 TETRADENTATE DIAMINODIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX, AND METHOD FOR MANUFACTURING SAME AND APPLICATION FOR SAME ADH4, ADH5, PF4 CYP1A2 1363/4885GAA 3778/4885ALDH1A1 219/4885
US-11639362-B2 Tetradentate diaminodiphosphine ligand and transition metal complex, and method for manufacturing same and application for same ADH4, ADH5, PF4 CYP1A2 1363/4885GAA 3778/4885ALDH1A1 219/4885
US-20220047724-A1 NOVEL TRICARBOCYANINE-CYCLODEXTRIN(S) CONJUGATES AND USE THEREOF KRTCAP2, DSC1, TBCD CYP1A2 3694/4885GAA 339/4885ALDH1A1 2627/4885
US-11840545-B1 Spirooxindole-copper complex as novel efficient anticorrosion agent for C-steel SOD1, CUL1, CTRC CYP1A2 2820/4885GAA 2449/4885ALDH1A1 926/4885
US-11179481-B2 Tricarbocyanine-cyclodextrin(s) conjugates and use thereof KRTCAP2, DSC1, TBCD CYP1A2 3832/4885GAA 244/4885ALDH1A1 2927/4885

“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.