SCHEMBL22581040

SCHEMBL22581040

CC(C)(C)OC(=O)N1CCC(CC2CCN(c3cc4c(cc3F)C(=O)N(C3CCC(=O)NC3=O)C4)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 17/20 0.47
▸ IKZF2 Q9UKS7 2/20 0.44
▸ IKZF1 Q13422 1/20 0.44
▸ IKZF3 Q9UKT9 4/20 0.43
▸ DDB1 Q16531 6/20 0.42
▸ GPR119 Q8TDV5 1/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ ADRA1D P25100 1/20 0.40
▸ ADRA1A P35348 1/20 0.40
▸ ADRA1B P35368 1/20 0.40

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
SCHEMBL29546738 0.92 CRBN (0.53) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL20231914 0.92 CRBN (0.53) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL29927969 0.92 IKZF2 (0.48) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL24718660 0.92 IKZF2 (0.48) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL26609923 0.91 CRBN (0.48) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL26609638 0.89 CRBN (0.51) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL26608662 0.89 CRBN (0.46) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL29132310 0.88 IKZF2 (0.50) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL29928099 0.88 IKZF2 (0.50) CRBNIKZF2IKZF1IKZF3DDB1
SCHEMBL25133245 0.88 IKZF2 (0.50) CRBNIKZF2IKZF1IKZF3DDB1

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-11485735-B2 Selective CDK4/6 inhibitor and preparation thereof WUXI SHUANGLIANG BIOTECHNOLOGY CO., LTD. (CN) 2022-11-01 — — US disclosed
US-20200339572-A1 NOVEL SELECTIVE CDK4/6 INHIBITOR AND PREPARATION THEREOF WUXI SHUANGLIANG BIOTECHNOLOGY CO., LTD. (CN) 2020-10-29 — — 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 (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-11485735-B2 Selective CDK4/6 inhibitor and preparation thereof CDK4, CDK6, CDK3 CRBN 835/4885IKZF2 1839/4885IKZF1 1337/4885
US-20200339572-A1 NOVEL SELECTIVE CDK4/6 INHIBITOR AND PREPARATION THEREOF CDK4, CDK6, CCNI CRBN 1124/4885IKZF2 3515/4885IKZF1 2441/4885

“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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