SCHEMBL21113313

SCHEMBL21113313

CCOC(=O)c1cc2cc(-c3cncn3C)cn2c(C(C)=O)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.46
MMP13 P45452 1/20 0.46
MMP14 P50281 1/20 0.46
EED O75530 1/20 0.38
RBBP4 Q09028 1/20 0.38
SUZ12 Q15022 1/20 0.38
EZH2 Q15910 1/20 0.38
AEBP2 Q6ZN18 1/20 0.38
BAZ2B Q9UIF8 1/20 0.38
BAZ2A Q9UIF9 1/20 0.38
KDM4E B2RXH2 7/20 0.34
GAA P10253 6/20 0.34
ALDH1A1 P00352 6/20 0.34
HPGD P15428 4/20 0.34
HSD17B10 Q99714 3/20 0.34
NPC1 O15118 4/20 0.34
POLB P06746 1/20 0.34
GLA P06280 3/20 0.33
RAB9A P51151 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL21113225 0.81 EED (0.39) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113232 0.81 PIK3CD (0.38) BAZ2BBAZ2AKDM4EGAAALDH1A1
SCHEMBL21113282 0.81 BAZ2B (0.37) BAZ2BBAZ2AKDM4EGAAALDH1A1
SCHEMBL19964897 0.81 CASP1 (0.45) MMP2MMP13MMP14KDM4EALDH1A1
SCHEMBL21113398 0.80 BAZ2B (0.39) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113150 0.80 EED (0.37) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL21113341 0.80 ALDH1A1 (0.39) KDM4EGAAALDH1A1HPGDHSD17B10
SCHEMBL21113259 0.79 RAB9A (0.48) MMP2MMP13MMP14KDM4EGAA
SCHEMBL21113246 0.79 BAZ2B (0.38) BAZ2BBAZ2AKDM4EGAAALDH1A1
SCHEMBL21156584 0.78 BAZ2B (0.35) BAZ2BBAZ2AKDM4EGAAALDH1A1

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 6 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
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
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 MMP2 4741/4885MMP13 4200/4885MMP14 4071/4885
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF EZH2, IKZF2, SUZ12 MMP2 4741/4885MMP13 4200/4885MMP14 4071/4885

“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.