SCHEMBL29608104

SCHEMBL29608104

COC(=O)c1cc(Cl)c(O)c(O)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
ABL1 P00519 1/20 0.42
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA7 P43166 3/20 0.42
CA9 Q16790 3/20 0.42
CA14 Q9ULX7 3/20 0.42
PDK2 Q15119 1/20 0.42
PDK4 Q16654 1/20 0.42
LMNA P02545 3/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
NFKB1 P19838 1/20 0.41
XDH P47989 1/20 0.41
GFER P55789 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
FUT7 Q11130 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL18394239 1.00 GAA (0.47) GAAABL1CA12CA1CA2
SCHEMBL23822989 0.84 GAA (0.47) GAAABL1CA12CA1CA2
SCHEMBL9140296 0.83 GAA (0.49) GAAABL1CA12CA1CA2
SCHEMBL11061303 0.81 LMNA (0.53) GAACA12CA1CA2CA7
SCHEMBL18393956 0.81 CA12 (0.44) GAAABL1CA12CA1CA2
SCHEMBL30466425 0.81 CA12 (0.44) GAAABL1CA12CA1CA2
SCHEMBL5961044 0.79 GAA (0.49) GAAABL1CA12CA1CA2
SCHEMBL23822990 0.79 LMNA (0.41) GAAABL1LMNAKDM4ETDP1
SCHEMBL23823369 0.79 AKR1C2 (0.53) KDM4ETDP1HTTTSHRMEN1
SCHEMBL23823337 0.78 DHODH (0.41) GAAKDM4EPOLBSMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12516040-B2 Crystalline forms of 7-chloro-2-(4-3-methoxyazetidin-1-yl)cyclohexyl)-2,4-dimethyl-N-((6-methyl-4-(methylthio)-2-oxo-1,2-dihydropyridin-3-yl)methyl)benzo[d][1,3]dioxole-5-carboxamide CONSTELLATION PHARMACEUTICALS, INC. (US) 2026-01-06 US disclosed
WO-2025124531-A1 1, 3-BENZODIOXOL DERIVATIVES AND USES THEREOF GEWU BIO CO., LTD (CN) 2025-06-19 WO disclosed
CN-116194108-B Novel dioxoisoquinolinone derivatives and use thereof 韩美药品株式会社 2025-05-30 CN disclosed
CN-119954787-A Modulators of methyl-modified enzymes, compositions and uses thereof 星座制药公司 2025-05-09 CN disclosed
CN-115175905-B ZESTE enhancer homolog 2 inhibitors and uses thereof 西藏海思科制药有限公司 2025-03-25 CN disclosed
CN-111989325-B Modulators of methyl-modified enzymes, compositions and uses thereof 星座制药公司 2025-02-25 CN disclosed
CN-118852139-A Crystalline forms 星座制药公司 2024-10-29 CN disclosed
CN-118546163-A EZH2 inhibitor and application thereof in medicine 贝达药业股份有限公司 2024-08-27 CN disclosed
CN-114450279-B Crystalline forms 星座制药公司 2024-07-09 CN disclosed
CN-118236503-A EZH2 inhibition combination therapy for the treatment of cancer 星座制药公司 2024-06-25 CN disclosed
CN-113423710-B Novel heterocyclic tricyclic derivative compounds and use thereof 韩美药品株式会社 2024-06-14 CN disclosed
CN-116947856-A EZH2 inhibitor and preparation method and application thereof 星希尔生物科技(上海)有限公司 2023-10-27 CN disclosed
CN-115974856-B Preparation method of drug valmotustat for treating adult T-cell leukemia lymphoma 北京康立生医药技术开发有限公司 2023-08-11 CN disclosed
CN-116194108-A Novel dioxoisoquinolinone derivatives and use thereof 韩美药品株式会社 2023-05-30 CN disclosed
CN-116082320-A ZESTE enhancer homolog 2 inhibitors and uses thereof 海思科医药集团股份有限公司 2023-05-09 CN disclosed
CN-116018335-A Process for preparing 1, 3-benzodioxole derivatives 第一三共株式会社 2023-04-25 CN disclosed
US-20220251073-A1 CRYSTALLINE FORMS OF 7-CHLORO-2-(4-(3-METHOXYAZETIDIN-1-YL)CYCLOHEXYL)-2,4-DIMETHYL-N-((6-METHYL-4-(METHYLTHIO)-2-OXO-1,2-DIHYDROPYRIDIN-3-YL)METHYL)BENZO[D][1,3]DIOXOLE-5-CARBOXAMIDE CONSTELLATION PHARMACEUTICALS, INC. 2022-08-11 US disclosed
CN-114450279-A Crystalline forms of 7-chloro-2- (4- (3-methoxyazetidin-1-yl) cyclohexyl) -2, 4-dimethyl-N- ((6-methyl-4- (methylthio) -2-oxo-1, 2-dihydropyridin-3-yl) methyl) benzo [ D ] [1,3] dioxole-5-carboxamide 星座制药公司 2022-05-06 CN disclosed
CN-114423426-A EZH2 inhibition combination therapy for the treatment of cancer 星座制药公司 2022-04-29 CN 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-20220251073-A1 CRYSTALLINE FORMS OF 7-CHLORO-2-(4-(3-METHOXYAZETIDIN-1-YL)CYCLOHEXYL)-2,4-DIMETHYL-N-((6-METHYL-4-(METHYLTHIO)-2-OXO-1,2-DIHYDROPYRIDIN-3-YL)METHYL)BENZO[D][1,3]DIOXOLE-5-CARBOXAMIDE DOT1L, HDAC1, NSD1 GAA 148/4885ABL1 2496/4885CA12 2791/4885

“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.