SCHEMBL20420801

SCHEMBL20420801

COc1cccc(-c2ccc(-c3cc(=O)oc4ccccc34)s2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ CYP3A4 P08684 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ MAPK1 P28482 2/20 0.51
▸ CYP2D6 P10635 2/20 0.51
▸ CYP2C9 P11712 2/20 0.51
▸ CYP2C19 P33261 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ ALOX12 P18054 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ KCNA3 P22001 2/20 0.49
▸ ALDH1A1 P00352 4/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ BRD4 O60885 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.44
▸ MAOA P21397 2/20 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
SCHEMBL20420776 0.91 HPGD (0.55) HPGDKMT2ACYP3A4KDM4EMAPK1
SCHEMBL20420786 0.90 ALDH1A1 (0.52) HPGDKMT2ACYP3A4KDM4EMAPK1
SCHEMBL5396788 0.86 KCNA3 (0.62) HPGDKMT2ACYP3A4KDM4EMAPK1
SCHEMBL20420803 0.86 CA9 (0.49) HPGDCYP3A4TP53ALDH1A1RAB9A
SCHEMBL20420780 0.82 CA12 (0.52) HPGDCYP3A4KDM4EMAPK1CYP2D6
SCHEMBL20420779 0.81 CA12 (0.53) MAPTKCNA3MAOACYP1A1CYP1A2
SCHEMBL20420799 0.81 CA12 (0.49) MAPK1TP53MAPTTSHRALOX12
SCHEMBL20420768 0.81 ABCG2 (0.47) HPGDKMT2ACYP3A4KDM4EMAPK1
SCHEMBL20420721 0.80 APP (0.58) HPGDKMT2ACYP3A4KDM4EMAPK1
SCHEMBL20420715 0.79 CA12 (0.49) ALDH1A1MAOACYP1A1CYP1A2CYP1B1

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 HPGD 2933/4885KMT2A 4058/4885CYP3A4 52/4885
US-20180282315-A1 4-SUBSTITUTED COUMARIN DERIVATIVES AND PREPARATION METHODS AND USES THEREOF MAP4, TUBA3C, ABCC1 HPGD 2933/4885KMT2A 4058/4885CYP3A4 52/4885

“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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