SCHEMBL20212171

SCHEMBL20212171

Nc1nc(Cl)cc(/C=C/C(=O)O)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ HSP90AB1 P08238 4/20 0.39
▸ HSP90AA1 P07900 3/20 0.39
▸ KMT2A Q03164 3/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ PLAU P00749 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ GRM4 Q14833 3/20 0.35
▸ RAB9A P51151 1/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ TNKS O95271 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ HDAC7 Q8WUI4 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC10 Q969S8 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
SCHEMBL20223056 0.85 KDM4E (0.41) KDM4ELMNAHSP90AB1HSP90AA1KMT2A
SCHEMBL20223478 0.77 TTR (0.43) KDM4EKMT2ARAB9AHCAR2MAPT
SCHEMBL30036780 0.77 TTR (0.43) KDM4EKMT2ARAB9AHCAR2MAPT
SCHEMBL27403418 0.74 HSP90AB1 (0.43) KDM4ELMNAHSP90AB1HSP90AA1KMT2A
SCHEMBL3187493 0.72 GRM4 (0.66) KDM4EHSP90AB1HSP90AA1KMT2AMEN1
SCHEMBL3187486 0.72 GRM4 (0.66) KDM4EHSP90AB1HSP90AA1KMT2AMEN1
SCHEMBL21200646 0.72 HCAR2 (0.48) KDM4ELMNAKMT2ANPSR1MEN1
SCHEMBL21200743 0.72 HCAR2 (0.48) KDM4ELMNAKMT2ANPSR1MEN1
SCHEMBL7420123 0.71 HSP90AB1 (0.42) KDM4ELMNAHSP90AB1HSP90AA1KMT2A
SCHEMBL10619597 0.71 CYP2D6 (0.40) KDM4ELMNAHSP90AB1HSP90AA1KMT2A

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
CN-110177780-B Pyrimidine compounds containing acidic groups 阿普罗斯治疗公司 2022-11-01 — — CN disclosed
EP-3548478-B1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS APROS THERAPEUTICS INC (US) 2021-11-17 — — EP disclosed
US-11173157-B2 Substituted pyrimidines containing acidic groups as TLR7 modulators Apros Therapeutics, Inc. (US) 2021-11-16 — — US disclosed
US-20210000826-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS AS TLR7 MODULATORS Apros Therapeutics, Inc. 2021-01-07 — — US disclosed
US-10786502-B2 Substituted pyrimidines containing acidic groups as TLR7 modulators Apros Therapeutics, Inc. (US) 2020-09-29 — — US disclosed
US-20190314372-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS Apros Therapeutics, Inc. 2019-10-17 — — US disclosed
EP-3548478-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS Apros Therapeutics, Inc. (US) 2019-10-09 — — EP disclosed
US-10287253-B2 Substituted pyrimidines containing acidic groups as TLR7 modulators Apros Therapeutics, Inc. (US) 2019-05-14 — — US disclosed
WO-2018106606-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS Apros Therapeutics, Inc. (US) 2018-06-14 — — WO disclosed
US-20180155298-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS Apros Therapeutics, Inc. 2018-06-07 — — 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 (6 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-20210000826-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS AS TLR7 MODULATORS TLR7, TLR9, STING1 KDM4E 2413/4885LMNA 4121/4885HSP90AB1 1814/4885
US-20180155298-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS MAVS, TLR7, STING1 KDM4E 3029/4885LMNA 4274/4885HSP90AB1 1708/4885
US-20190314372-A1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS MAVS, TLR7, STING1 KDM4E 3029/4885LMNA 4274/4885HSP90AB1 1708/4885
US-10287253-B2 Substituted pyrimidines containing acidic groups as TLR7 modulators TLR7, TLR9, MAVS KDM4E 2050/4885LMNA 4400/4885HSP90AB1 1257/4885
US-11173157-B2 Substituted pyrimidines containing acidic groups as TLR7 modulators TLR7, TLR9, MAVS KDM4E 2050/4885LMNA 4400/4885HSP90AB1 1257/4885
US-10786502-B2 Substituted pyrimidines containing acidic groups as TLR7 modulators TLR7, TLR9, MAVS KDM4E 2050/4885LMNA 4400/4885HSP90AB1 1257/4885

“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.

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