SCHEMBL29663267

SCHEMBL29663267

CON(C)C(=O)c1cc(C(C)C)n(C2CCCCO2)n1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 1/20 0.34
▸ S1PR3 Q99500 1/20 0.34
▸ RET P07949 4/20 0.33
▸ CYP4F2 P78329 3/20 0.33
▸ CYP4A11 Q02928 3/20 0.33
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ SLC6A3 Q01959 4/20 0.33
▸ ATR Q13535 6/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL29835147 0.85 CYP4F2 (0.39) S1PR3CYP4F2CYP4A11RXRARXRB
SCHEMBL24934378 0.78 ATR (0.40) CYP4F2CYP4A11RXRARXRBRXRG
SCHEMBL21835567 0.76 CD274 (0.39) S1PR1S1PR3CYP4F2CYP4A11RXRA
SCHEMBL22824029 0.75 CYP4F2 (0.38) RETCYP4F2CYP4A11RXRARXRB
SCHEMBL15244570 0.74 RXRA (0.38) RETCYP4F2CYP4A11RXRARXRB
SCHEMBL21187505 0.74 GAA (0.43) RETCYP4F2CYP4A11RXRARXRB
SCHEMBL30429840 0.73 RET (0.36) RETCYP4F2CYP4A11RXRARXRB
SCHEMBL30430129 0.73 RET (0.37) RETCYP4F2CYP4A11RXRARXRB
SCHEMBL31467472 0.73 BAZ2B (0.34) RAB9A
SCHEMBL21185044 0.72 RET (0.50) RETCYP4F2CYP4A11RXRARXRB

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-20220289751-A1 COMPOUND HAVING KDM5 INHIBITORY ACTIVITY AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2022-09-15 — — US disclosed
EP-3999183-A1 COMPOUND HAVING KDM5 INHIBITORY ACTIVITY AND PHARMACEUTICAL USE THEREOF Ono Pharmaceutical Co., Ltd. (JP) 2022-05-25 — — EP 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-20220289751-A1 COMPOUND HAVING KDM5 INHIBITORY ACTIVITY AND PHARMACEUTICAL USE THEREOF KDM5A, KDM1B, KDM5D S1PR1 3479/4885S1PR3 3907/4885RET 1856/4885

“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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