SCHEMBL12373457

SCHEMBL12373457

CCn1c(C(C)C)cnc1Cl

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
CCND2 P30279 1/20 0.33
CCND3 P30281 1/20 0.33
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
BTK Q06187 1/20 0.30

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
SCHEMBL2280840 0.85 CDK4 (0.31) CDK4CCND1CCND2CCND3
SCHEMBL2282120 0.85 MLYCD (0.33) CDK4CCND1CCND2CCND3LMNA
SCHEMBL24730772 0.72 PTGER4 (0.33) LMNA
SCHEMBL23565938 0.68 MEN1 (0.37) SMN1; SMN2BTK
SCHEMBL21737035 0.68 LMNA (0.34) LMNASMN1; SMN2
SCHEMBL13384404 0.67 MAPK1 (0.35) LMNASMN1; SMN2
SCHEMBL2276439 0.67 PTGER4 (0.38)
SCHEMBL18595554 0.66 ALDH1A1 (0.32)
SCHEMBL12285120 0.65 TSHR (0.35) LMNASMN1; SMN2
SCHEMBL21653345 0.65 GRIA1 (0.35) LMNASMN1; SMN2

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-7994204-B2 Binding inhibitor of sphingosine-1-phosphate TAISHO PHARMACEUTICAL CO., LTD (JP) 2011-08-09 US disclosed
US-20090182144-A1 BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-07-16 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 (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-20090182144-A1 BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE S1PR1, S1PR3, S1PR2 CDK4 4556/4885CCND1 3697/4885CCND2 4027/4885

“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.