SCHEMBL21113320

SCHEMBL21113320

C=C(c1c(C)c(C(=O)OC(C)C)cc2c(-c3ccc(C)nn3)ccn12)N1CCN(CC(F)(F)F)CC1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 10/20 0.38
EED O75530 9/20 0.38
RBBP4 Q09028 9/20 0.38
SUZ12 Q15022 9/20 0.38
AEBP2 Q6ZN18 9/20 0.38
METAP2 P50579 1/20 0.33
OPRK1 P41145 3/20 0.32
P2RX3 P56373 1/20 0.31
P2RX2 Q9UBL9 1/20 0.31
SPR P35270 1/20 0.30

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
SCHEMBL25514496 0.91 OPRK1 (0.34) EZH2OPRK1
SCHEMBL22802156 0.90 EZH2 (0.37) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL28886501 0.86 OPRK1 (0.31) EZH2OPRK1
SCHEMBL21156606 0.86 EZH2 (0.34) EZH2OPRK1
SCHEMBL29986791 0.86 EZH2 (0.34) EZH2OPRK1
SCHEMBL21113275 0.84 LRRK2 (0.33) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL21113520 0.83 EZH2 (0.49) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL21113360 0.79 ATR (0.35) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL21342282 0.78 EZH2 (0.63) EZH2EEDRBBP4SUZ12AEBP2
SCHEMBL21113394 0.77 EZH2 (0.33) EZH2EEDRBBP4SUZ12AEBP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661421-B2 Indolizine compounds, preparation method and use thereof HAIHE BIOPHARMA CO., LTD. (CN) 2023-05-30 US disclosed
US-11661421-B2 Indolizine compounds, preparation method and use thereof HAIHE BIOPHARMA CO., LTD. (CN) 2023-05-30 US disclosed
CN-110229151-B Indolizine compound, preparation method and application thereof 上海海和药物研究开发股份有限公司 2021-09-10 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
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
US-20200399270-A1 INDOLIZINE COMPOUNDS, PREPARATION METHOD AND USE THEREOF HAIHE BIOPHARMA CO., LTD. (CN) 2020-12-24 US disclosed
US-20200399270-A1 INDOLIZINE COMPOUNDS, PREPARATION METHOD AND USE THEREOF HAIHE BIOPHARMA CO., LTD. (CN) 2020-12-24 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
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 (4 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-11661421-B2 Indolizine compounds, preparation method and use thereof EZH1, EZH2, IKZF3 EZH2 2/4885EED 12/4885RBBP4 1315/4885
US-10968215-B2 Pyrido five-element aromatic ring compound, preparation method therefor and use thereof EZH2, IKZF2, SUZ12 EZH2 1/4885EED 41/4885RBBP4 288/4885
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF EZH2, IKZF2, SUZ12 EZH2 1/4885EED 41/4885RBBP4 288/4885
US-20200399270-A1 INDOLIZINE COMPOUNDS, PREPARATION METHOD AND USE THEREOF EZH1, EZH2, IKZF3 EZH2 2/4885EED 12/4885RBBP4 1315/4885

“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.