SCHEMBL20420721

SCHEMBL20420721

COc1ccccc1-c1ccc(-c2cc(=O)oc3ccccc23)s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.58
▸ CYP3A4 P08684 5/20 0.50
▸ KDM4E B2RXH2 5/20 0.50
▸ ALDH1A1 P00352 5/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ HPGD P15428 4/20 0.50
▸ TSHR P16473 4/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ CYP2C19 P33261 3/20 0.50
▸ CYP2C9 P11712 2/20 0.50
▸ KCNA3 P22001 1/20 0.49
▸ CYP2A6 P11509 1/20 0.48
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ HDAC6 Q9UBN7 2/20 0.46
▸ ALOX15 P16050 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ GMNN O75496 1/20 0.46

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
SCHEMBL20428335 0.88 APP (0.52) APPCYP3A4KDM4EALDH1A1KMT2A
SCHEMBL20420768 0.85 ABCG2 (0.47) CYP3A4KDM4EALDH1A1KMT2AHPGD
SCHEMBL20420786 0.82 ALDH1A1 (0.52) APPCYP3A4KDM4EALDH1A1KMT2A
SCHEMBL20420716 0.81 ALDH1A1 (0.52) CYP3A4KDM4EALDH1A1KMT2AHPGD
SCHEMBL20420801 0.80 HPGD (0.51) CYP3A4KDM4EALDH1A1KMT2AHPGD
SCHEMBL20420760 0.80 CA12 (0.53) ALDH1A1KMT2AMEN1KCNA3CYP1A2
SCHEMBL20420803 0.79 CA9 (0.49) CYP3A4ALDH1A1HPGDHSD17B10NPC1
SCHEMBL20420799 0.77 CA12 (0.49) ALDH1A1TSHRMAPTALOX15SMN1; SMN2
SCHEMBL20420794 0.76 NQO1 (0.47) CYP3A4KDM4EALDH1A1KMT2AHPGD
SCHEMBL12973253 0.76 APP (1.00) APPCYP3A4KDM4EALDH1A1HPGD

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 APP 3623/4885CYP3A4 52/4885KDM4E 1307/4885
US-20180282315-A1 4-SUBSTITUTED COUMARIN DERIVATIVES AND PREPARATION METHODS AND USES THEREOF MAP4, TUBA3C, ABCC1 APP 3623/4885CYP3A4 52/4885KDM4E 1307/4885

“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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