SCHEMBL29877994

SCHEMBL29877994

Cc1ccc(C(=O)O)nc1C#N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ TDP1 Q9NUW8 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ ACMSD Q8TDX5 1/20 0.42
▸ MGAM O43451 1/20 0.39
▸ P4HTM Q9NXG6 2/20 0.37
▸ P4HA1 P13674 1/20 0.37
▸ MIF P14174 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 4/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ ECE1 P42892 1/20 0.35
▸ NAPRT Q6XQN6 1/20 0.34
▸ CHEK1 O14757 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
SCHEMBL13093855 1.00 KDM4E (0.43) KDM4EL3MBTL1TDP1MAPTRAB9A
SCHEMBL13202515 0.85 ALDH1A1 (0.35) KDM4EMAPTALOX15ALDH1A1LMNA
SCHEMBL29877508 0.81 MAPK1 (0.41) KDM4EL3MBTL1MAPTRAB9AALDH1A1
SCHEMBL27398471 0.81 PARP1 (0.41) RAB9AALDH1A1
SCHEMBL23530284 0.79 KDM4E (0.43) KDM4EL3MBTL1TDP1MAPTRAB9A
SCHEMBL2974571 0.78 KDM4E (0.42) KDM4EL3MBTL1TDP1MAPTRAB9A
SCHEMBL12870164 0.78 KDM4E (0.51) KDM4EL3MBTL1TDP1MAPTRAB9A
Hydrochloric Acid SCHEMBL29169667 0.76 KDM4E (0.41) KDM4EL3MBTL1TDP1MAPTRAB9A
SCHEMBL701941 0.74 KDM4E (0.60) KDM4EL3MBTL1TDP1MAPTRAB9A
SCHEMBL16847886 0.72 CHEK1 (0.34) KDM4ETSHRALDH1A1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240317752-A1 6-SUBSTITUTED-9H-PURINE DERIVATIVES AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2024-09-26 — — US disclosed
WO-2022178256-A1 6-SUBSTITUTED-9H-PURINE DERIVATIVES AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-08-25 — — 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 (1 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-20240317752-A1 6-SUBSTITUTED-9H-PURINE DERIVATIVES AND RELATED USES TYMP, DPYD, PNP KDM4E 3183/4885L3MBTL1 3375/4885TDP1 466/4885

“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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