SCHEMBL21113468

SCHEMBL21113468

CCOC(=O)c1cc2c(-c3ccnc4c3CCN4C(=O)OC(C)(C)C)ccn2c(C(C)=O)c1C

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
ADORA1 P30542 1/20 0.32
HPGD P15428 3/20 0.32
ALDH1A1 P00352 3/20 0.32
GAA P10253 2/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
UCHL1 P09936 2/20 0.32
KDM4E B2RXH2 2/20 0.32
GLA P06280 1/20 0.32
GPR119 Q8TDV5 2/20 0.31
JMJD6 Q6NYC1 1/20 0.30
ATM Q13315 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
SCHEMBL21113068 0.79 EZH2 (0.33)
SCHEMBL21113394 0.78 EZH2 (0.33)
SCHEMBL21113454 0.74 EED (0.35)
SCHEMBL21113457 0.74 EED (0.45)
SCHEMBL21342276 0.74 CDK5 (0.42) HPGDALDH1A1GAAKDM4EGLA
SCHEMBL19964483 0.74 ROCK2 (0.35) MEN1KMT2ATP53POLBHPGD
SCHEMBL19964717 0.70 EZH2 (0.39) HPGDALDH1A1GAANPSR1KDM4E
SCHEMBL21342364 0.70 EZH2 (0.45) MEN1KMT2ATP53HPGDALDH1A1
SCHEMBL19964530 0.70 ALDH1A1 (0.46) MEN1KMT2ATP53HPGDALDH1A1
SCHEMBL19964962 0.70 EED (0.38) HPGDALDH1A1GAASMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MEN1 428/4885KMT2A 222/4885TP53 304/4885
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF EZH2, IKZF2, SUZ12 MEN1 428/4885KMT2A 222/4885TP53 304/4885

“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.