SCHEMBL23995372

SCHEMBL23995372

O=c1[nH]cc(-c2cc(NCCc3ccc(Cl)cc3)c3nccn3n2)c(=O)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.43
▸ GPR84 Q9NQS5 1/20 0.39
▸ GSK3B P49841 4/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.37
▸ GSK3A P49840 3/20 0.34
▸ SYK P43405 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CCNC P24863 1/20 0.34
▸ CDK8 P49336 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ JAK3 P52333 1/20 0.34

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
SCHEMBL23994321 0.92 MEN1 (0.54) MEN1KMT2AMAPTKDM4ETAAR1
SCHEMBL23995391 0.91 MAPT (0.43) MEN1KMT2AMAPTKDM4ETAAR1
SCHEMBL23995086 0.90 KDM4E (0.46) MEN1KMT2AMAPTKDM4ETAAR1
SCHEMBL23995083 0.86 KDM4E (0.47) MEN1KMT2AMAPTKDM4ETAAR1
SCHEMBL30224272 0.85 GPR84 (0.41) MEN1KMT2AMAPTKDM4ETAAR1
SCHEMBL23994963 0.85 GPR84 (0.41) MEN1KMT2AMAPTKDM4ETAAR1
SCHEMBL23995221 0.85 CDK2 (0.42) MEN1KMT2AMAPTLMNATSHR
SCHEMBL23995088 0.85 MAPT (0.46) MEN1KMT2AMAPTKDM4ETAAR1
SCHEMBL23995084 0.83 MEN1 (0.44) MEN1KMT2AMAPTKDM4ETAAR1
SCHEMBL30224471 0.83 MEN1 (0.44) MEN1KMT2AMAPTKDM4ETAAR1

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
US-12110294-B2 CD73 compounds GILEAD SCIENCES, INC. (US) 2024-10-08 — — US disclosed
EP-4143194-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-03-08 — — EP disclosed
US-20230039553-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. 2023-02-09 — — US disclosed
WO-2021222522-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2021-11-04 — — WO 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-20230039553-A1 CD73 COMPOUNDS ENTPD5, ENTPD1, NT5E MEN1 3132/4885KMT2A 2253/4885MAPT 4826/4885
US-12110294-B2 CD73 compounds ENTPD5, ENTPD1, NT5E MEN1 3362/4885KMT2A 2581/4885MAPT 4849/4885

“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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