SCHEMBL23844239

SCHEMBL23844239

CCC1CCN(c2cccc(C(C)C)c2)C1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.60
HRH3 Q9Y5N1 2/20 0.55
BPTF Q12830 1/20 0.48
ACACB O00763 7/20 0.39
GRM2 Q14416 1/20 0.38
USP30 Q70CQ3 1/20 0.38
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
KCNH2 Q12809 1/20 0.37
RXRA P19793 2/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2B Q13224 2/20 0.36
BCL9 O00512 2/20 0.36
CTNNB1 P35222 2/20 0.36

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
SCHEMBL16775751 0.81 NOTUM (0.64) NOTUMHRH3BPTFACACBGRM2
SCHEMBL17618325 0.81 NOTUM (0.64) NOTUMHRH3BPTFACACBGRM2
SCHEMBL12958809 0.81 NOTUM (0.64) NOTUMHRH3BPTFACACBGRM2
SCHEMBL16775752 0.81 NOTUM (0.64) NOTUMHRH3BPTFACACBGRM2
SCHEMBL17618324 0.81 NOTUM (0.64) NOTUMHRH3BPTFACACBGRM2
SCHEMBL12958780 0.81 NOTUM (0.64) NOTUMHRH3BPTFACACBGRM2
SCHEMBL25016596 0.79 NOTUM (0.67) NOTUMHRH3ACACB
SCHEMBL19088692 0.79 NOTUM (0.50) NOTUMHRH3BPTFACACBBCL9
SCHEMBL23844238 0.79 NOTUM (0.58) NOTUMHRH3ACACBDRD2DRD3
SCHEMBL4396441 0.78 DPP4 (0.51) NOTUMHRH3BPTFDRD2

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-20220169631-A9 TAIRE FAMILY KINASE INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-06-02 US disclosed
US-20210292299-A1 TAIRE FAMILY KINASE INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-09-23 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-20220169631-A9 TAIRE FAMILY KINASE INHIBITORS AND USES THEREOF CDK14, CDK16, CDK19 NOTUM 3306/4885HRH3 3055/4885BPTF 4461/4885
US-20210292299-A1 TAIRE FAMILY KINASE INHIBITORS AND USES THEREOF CDK14, CDK16, CDK19 NOTUM 3306/4885HRH3 3055/4885BPTF 4461/4885

“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.