SCHEMBL21113458

SCHEMBL21113458

COCc1cc2cc(-c3cc(OC)c(OC)c(OC)c3)cn2c(C(=O)O)c1C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EED O75530 1/20 0.62
RBBP4 Q09028 1/20 0.62
SUZ12 Q15022 1/20 0.62
EZH2 Q15910 1/20 0.62
AEBP2 Q6ZN18 1/20 0.62
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.34
MAP3K11 Q16584 1/20 0.34
EDNRB P24530 3/20 0.33
EDNRA P25101 2/20 0.33
POLB P06746 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
CYP3A4 P08684 2/20 0.33
MEN1 O00255 1/20 0.33
GFER P55789 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL21113354 0.88 EED (0.60) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113286 0.78 EZH2 (1.00) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL28886572 0.78 EED (0.43) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113241 0.72 EED (0.42) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21156141 0.65 TSHR (0.40) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL14660480 0.63 TPMT (0.44) MAPTALDH1A1HPGDKDM4EL3MBTL1
SCHEMBL4601016 0.61 NEK2 (0.52) MAPTALDH1A1HPGDKDM4EPOLB
SCHEMBL721861 0.60 ACHE (0.65) MAPTALDH1A1HPGDKDM4EL3MBTL1
SCHEMBL2037868 0.60 RXRA (0.64) MAPTL3MBTL1POLBMEN1KMT2A
SCHEMBL29986364 0.58 MAP3K11 (0.48) MAP3K11ERN1TUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109790160-B Pyrido five-membered aromatic ring compound, preparation method and application thereof 上海海和药物研究开发股份有限公司 2022-11-15 CN disclosed
US-10968215-B2 Pyrido five-element aromatic ring compound, preparation method therefor and use thereof SHANGHAI HAIHE PHARMACEUTICAL CO., LTD. (CN) 2021-04-06 US disclosed
EP-3524602-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Haihe Pharmaceutical Co., Ltd. (CN) 2019-08-14 EP disclosed
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF HAIHE BIOPHARMA CO. LTD. (CN) 2019-07-11 US 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-10968215-B2 Pyrido five-element aromatic ring compound, preparation method therefor and use thereof EZH2, IKZF2, SUZ12 EED 41/4885RBBP4 288/4885SUZ12 3/4885
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF EZH2, IKZF2, SUZ12 EED 41/4885RBBP4 288/4885SUZ12 3/4885

“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.