SCHEMBL22478151

SCHEMBL22478151

CC(C)(C)c1cc(-c2c[nH]nc2C(F)(F)F)nc2ccc3[nH]ncc3c12

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 18/20 0.48
▸ CCNA1 P78396 18/20 0.48
▸ FLT3 P36888 15/20 0.48
▸ PBK Q96KB5 1/20 0.39
▸ STING1 Q86WV6 1/20 0.38
▸ TRPA1 O75762 1/20 0.37
▸ AXL P30530 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
SCHEMBL22466879 0.87 CDK2 (0.49) CDK2CCNA1FLT3PBKSTING1
SCHEMBL30490713 0.87 CDK2 (0.49) CDK2CCNA1FLT3PBKSTING1
SCHEMBL22477866 0.83 CDK2 (0.58) CDK2CCNA1FLT3PBKSTING1
SCHEMBL22467004 0.82 CDK2 (0.46) CDK2CCNA1FLT3PBK
SCHEMBL30490709 0.82 CDK2 (0.46) CDK2CCNA1FLT3PBK
SCHEMBL22477920 0.82 CDK2 (0.59) CDK2CCNA1FLT3PBKSTING1
SCHEMBL22467416 0.82 CDK2 (0.71) CDK2CCNA1FLT3PBKTRPA1
SCHEMBL22466906 0.81 CDK2 (0.50) CDK2CCNA1FLT3PBKTRPA1
SCHEMBL30490738 0.81 CDK2 (0.50) CDK2CCNA1FLT3PBKTRPA1
SCHEMBL22478032 0.81 CDK2 (0.52) CDK2CCNA1FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210371420-A1 INHIBITORS OF KINASE NETWORKS AND USES THEREOF PURDUE RESEARCH FOUNDATION 2021-12-02 — — US disclosed
US-11040973-B2 Inhibitors of kinase networks and uses thereof PURDUE RESEARCH FOUNDATION 2021-06-22 — — US disclosed
US-20200308173-A1 INHIBITORS OF KINASE NETWORKS AND USES THEREOF PURDUE RESEARCH FOUNDATION 2020-10-01 — — 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 (3 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-20200308173-A1 INHIBITORS OF KINASE NETWORKS AND USES THEREOF KDM1B, JMJD6, KDM1A CDK2 308/4885CCNA1 2225/4885FLT3 556/4885
US-11040973-B2 Inhibitors of kinase networks and uses thereof KDM1B, JMJD6, KDM1A CDK2 308/4885CCNA1 2225/4885FLT3 556/4885
US-20210371420-A1 INHIBITORS OF KINASE NETWORKS AND USES THEREOF KDM1B, JMJD6, KDM1A CDK2 308/4885CCNA1 2225/4885FLT3 556/4885

“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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