SCHEMBL23330650

SCHEMBL23330650

NNc1nc(Cl)ncc1NC(=O)C1CCCOC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 6/20 0.47
▸ HDAC2 Q92769 6/20 0.47
▸ HDAC3 O15379 4/20 0.47
▸ HTR1A P08908 2/20 0.35
▸ DRD4 P21917 2/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ KMT2A Q03164 1/20 0.34
▸ MAPK8 P45983 2/20 0.34
▸ MAPK9 P45984 1/20 0.34
▸ CDK9 P50750 2/20 0.33
▸ PIP5K1B O14986 1/20 0.33
▸ PIP5K1C O60331 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ MAPK10 P53779 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ PIP5K1A Q99755 1/20 0.33
▸ P2RX3 P56373 1/20 0.33
▸ EGLN2 Q96KS0 1/20 0.33
▸ CNR2 P34972 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
SCHEMBL24978674 0.93 HDAC1 (0.42) HDAC1HDAC2HDAC3MAPK8PIP5K1B
SCHEMBL23330999 0.87 HDAC3 (0.40) HDAC1HDAC2HDAC3KMT2A
SCHEMBL24978407 0.87 HDAC3 (0.43) HDAC1HDAC2HDAC3KMT2A
SCHEMBL23330648 0.86 HDAC3 (0.46) HDAC1HDAC2HDAC3HTR1ADRD4
SCHEMBL23331078 0.86 HDAC1 (0.49) HDAC1HDAC2HDAC3KMT2AP2RX3
SCHEMBL23300902 0.84 MAP4K1 (0.42) KMT2A
SCHEMBL24978425 0.81 HSD17B10 (0.47) KMT2A
SCHEMBL24978673 0.78 PIP5K1C (0.41) HDAC1HDAC2HDAC3MAPK8PIP5K1B
SCHEMBL24978418 0.78 HDAC3 (0.46) HDAC1HDAC2HDAC3KMT2A
SCHEMBL23331082 0.73 HTT (0.39) KMT2A

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-20230028221-A1 EED INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF JING MEDICINE TECHNOLOGY (SHANGHAI) LTD. (CN) 2023-01-26 — — US disclosed
WO-2021083380-A1 EED INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海科技大学 2021-05-06 — — 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-20230028221-A1 EED INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP4F11, CYP4A11, HSD11B1 HDAC1 1446/4885HDAC2 2456/4885HDAC3 3383/4885

“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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