SCHEMBL20420775

SCHEMBL20420775

COc1cc(-c2ccc(-c3cc(=O)oc4ccccc34)o2)cc(OC)c1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.53
▸ ALOX5 P09917 1/20 0.53
▸ LCK P06239 1/20 0.49
▸ ABCG2 Q9UNQ0 1/20 0.49
▸ CYP1A1 P04798 1/20 0.48
▸ CYP1B1 Q16678 1/20 0.48
▸ CSNK2A2 P19784 2/20 0.47
▸ CSNK2B P67870 2/20 0.47
▸ CSNK2A1 P68400 2/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ HPGD P15428 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ CYP3A4 P08684 3/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ GLA P06280 1/20 0.47

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
SCHEMBL20428422 0.86 NQO1 (0.49) PTGESALOX5LCKABCG2ALDH1A1
SCHEMBL20420805 0.85 ALDH1A1 (0.51) ABCG2CSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL20420716 0.84 ALDH1A1 (0.52) CYP1A1CYP1B1ALDH1A1HPGDKMT2A
SCHEMBL20420788 0.82 ALDH1A1 (0.61) ABCG2ALDH1A1HPGDKMT2AKDM4E
SCHEMBL20420768 0.81 ABCG2 (0.47) PTGESALOX5LCKABCG2CYP1A1
SCHEMBL20420777 0.80 CA9 (0.54) ABCG2CYP1A1CYP1B1HPGDKMT2A
SCHEMBL9528168 0.78 LCK (0.78) PTGESALOX5LCKABCG2CYP1A1
SCHEMBL20420761 0.78 MAOB (0.58) ABCG2CYP1B1ALDH1A1HPGDKMT2A
SCHEMBL20420727 0.75 TNKS (0.58) ABCG2CYP1A1CYP1B1HPGDKMT2A
SCHEMBL20428325 0.74 HPGD (0.61) ABCG2CYP1B1ALDH1A1HPGDKMT2A

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 PTGES 3771/4885ALOX5 3687/4885LCK 1357/4885
US-20180282315-A1 4-SUBSTITUTED COUMARIN DERIVATIVES AND PREPARATION METHODS AND USES THEREOF MAP4, TUBA3C, ABCC1 PTGES 3771/4885ALOX5 3687/4885LCK 1357/4885

“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.

Send feedback