SCHEMBL20420799

SCHEMBL20420799

Cc1ccc(-c2ccc(-c3cc(=O)oc4ccccc34)s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 5/20 0.49
▸ CA9 Q16790 5/20 0.49
▸ MAOB P27338 3/20 0.49
▸ TNKS O95271 1/20 0.49
▸ PARP1 P09874 1/20 0.49
▸ TNKS2 Q9H2K2 1/20 0.49
▸ PARP2 Q9UGN5 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.47
▸ MAPT P10636 2/20 0.47
▸ LMNA P02545 4/20 0.44
▸ TSHR P16473 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ RET P07949 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ NQO1 P15559 1/20 0.43
▸ MAOA P21397 2/20 0.43
▸ CA1 P00915 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL20420803 0.89 CA9 (0.49) CA12CA9MAOBTNKSPARP1
SCHEMBL20420715 0.86 CA12 (0.49) CA12CA9MAOBTNKSALDH1A1
SCHEMBL20420786 0.86 ALDH1A1 (0.52) MAOBTNKSALDH1A1MAPTLMNA
SCHEMBL20428397 0.86 ALDH1A1 (0.52) CA12CA9MAOBTNKSPARP1
SCHEMBL20420774 0.85 PTGS2 (0.44) CA12CA9NQO1CA1
SCHEMBL20420779 0.82 CA12 (0.53) CA12CA9MAOBTNKSMAPT
SCHEMBL20420745 0.81 MAOB (0.55) CA12CA9MAOBALDH1A1MAPT
SCHEMBL20420801 0.81 HPGD (0.51) ALDH1A1MAPTTSHRTP53ALOX12
SCHEMBL20420804 0.79 ALDH1A1 (0.54) TNKSPARP1TNKS2ALDH1A1MAPT
SCHEMBL20420768 0.79 ABCG2 (0.47) ALDH1A1MAPTTSHRSMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3354648-B1 4-SUBSTITUED COUMARIN DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF CHENGDU ZENITAR BIOMEDICAL TECH CO LTD (CN) 2022-04-06 — — EP disclosed
CN-108349959-B 4-substituted coumarin derivative and preparation method and application thereof 成都赜灵生物医药科技有限公司 2021-11-16 — — CN disclosed
US-10544134-B2 4-substituted coumarin derivatives and preparation methods and uses thereof GUIZHOU BAILING GROUP PHARMACEUTICAL CO., LTD. (CN) 2020-01-28 — — US disclosed
US-10544134-B2 4-substituted coumarin derivatives and preparation methods and uses thereof GUIZHOU BAILING GROUP PHARMACEUTICAL CO., LTD. (CN) 2020-01-28 — — US disclosed
US-20180282315-A1 4-SUBSTITUTED COUMARIN DERIVATIVES AND PREPARATION METHODS AND USES THEREOF CHENGDU ZENITAR BIOMEDICAL TECHNOLOGY CO., LTD. (CN) 2018-10-04 — — US disclosed
EP-3354648-A1 4-SUBSTITUED COUMARIN DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF Guizhou Bailing Group Pharmaceutical Co., Ltd. (CN) 2018-08-01 — — EP disclosed
EP-3354648-A1 4-SUBSTITUED COUMARIN DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF Guizhou Bailing Group Pharmaceutical Co., Ltd. (CN) 2018-08-01 — — EP disclosed
CN-108349959-A The coumarin derivative and its preparation method and application of 4 substitutions 贵州百灵企业集团制药股份有限公司 2018-07-31 — — 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 (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-10544134-B2 4-substituted coumarin derivatives and preparation methods and uses thereof MAP4, TUBA3C, ABCC1 CA12 3561/4885CA9 2723/4885MAOB 2670/4885
US-20180282315-A1 4-SUBSTITUTED COUMARIN DERIVATIVES AND PREPARATION METHODS AND USES THEREOF MAP4, TUBA3C, ABCC1 CA12 3561/4885CA9 2723/4885MAOB 2670/4885

“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.

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