SCHEMBL23933005

SCHEMBL23933005

COc1ccc(N)c(N(C)S(C)(=O)=O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
CYP3A4 P08684 1/20 0.44
CYP19A1 P11511 2/20 0.44
LMNA P02545 1/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 2/20 0.41
APLNR P35414 1/20 0.40
PTGS2 P35354 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
MCL1 Q07820 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CA2 P00918 2/20 0.39
KEAP1 Q14145 2/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL29686091 1.00 ALDH1A1 (0.44) ALDH1A1CYP3A4CYP19A1LMNAKMT2A
SCHEMBL30936872 0.89 CYP19A1 (0.37) ALDH1A1CYP3A4CYP19A1LMNAKMT2A
SCHEMBL30936865 0.89 CYP19A1 (0.37) ALDH1A1CYP3A4CYP19A1LMNAKMT2A
SCHEMBL26906921 0.87 ALDH1A1 (0.44) ALDH1A1CYP3A4CYP19A1LMNAKMT2A
SCHEMBL29686620 0.83 KMT2A (0.47) ALDH1A1CYP3A4CYP19A1LMNAKMT2A
SCHEMBL24498465 0.83 KMT2A (0.47) ALDH1A1CYP3A4CYP19A1LMNAKMT2A
SCHEMBL24498481 0.83 CYP19A1 (0.49) ALDH1A1CYP19A1LMNAKMT2AMAPT
SCHEMBL24497695 0.81 CYP2C9 (0.50) ALDH1A1CYP19A1LMNAKMT2AAPLNR
SCHEMBL26512973 0.81 LMNA (0.42) ALDH1A1CYP19A1LMNAKMT2AMAPT
SCHEMBL24498442 0.80 ALDH1A1 (0.39) ALDH1A1CYP3A4KMT2AMEN1MAPT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024094171-A1 SUBSTITUTED AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF 江苏恒瑞医药股份有限公司 2024-05-10 WO disclosed
US-20240101548-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHENZHEN CHIPSCREEN BIOSCIENCES CO., LTD (CN) 2024-03-28 US disclosed
EP-4257587-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2023-10-11 EP disclosed
EP-4257587-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2023-10-11 EP disclosed
US-20230159556-A1 NOVEL PROTEIN KINASE INHIBITORS TENOVA PHARMACEUTICALS INC. 2023-05-25 US disclosed
US-20230159556-A1 NOVEL PROTEIN KINASE INHIBITORS TENOVA PHARMACEUTICALS INC. 2023-05-25 US disclosed
US-20230159556-A1 NOVEL PROTEIN KINASE INHIBITORS TENOVA PHARMACEUTICALS INC. 2023-05-25 US disclosed
CN-114901656-B Hydroximic acid ester compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-04-07 CN disclosed
CN-114901656-A Hydroximic acid ester compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2022-08-12 CN disclosed
WO-2021216440-A1 NOVEL PROTEIN KINASE INHIBITORS TENOVA PHARMACEUTICALS INC. (US) 2021-10-28 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 (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-20240101548-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF TYK2, WEE2, WEE1 ALDH1A1 3779/4885CYP3A4 3656/4885CYP19A1 1198/4885
US-20230159556-A1 NOVEL PROTEIN KINASE INHIBITORS ERBB2, ALK, ERBB3 ALDH1A1 4050/4885CYP3A4 4830/4885CYP19A1 4431/4885

“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.