SCHEMBL23960443

SCHEMBL23960443

CCC(c1ccc(OC)cc1)(c1ccc(OC)cc1)c1ccc(-c2cc(OC)ccc2C(CC)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 10/20 0.46
KCNH2 Q12809 1/20 0.46
ABL1 P00519 1/20 0.42
ABCB1 P08183 1/20 0.42
BCR P11274 1/20 0.42
BACE1 P56817 2/20 0.41
SYK P43405 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
ACACA Q13085 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL13060384 0.82 KIF11 (0.62) KIF11KCNH2SMN1; SMN2
SCHEMBL462675 0.82 KIF11 (0.62) KIF11KCNH2SMN1; SMN2
SCHEMBL9713890 0.76 BACE1 (0.48) KIF11KCNH2ABL1ABCB1BCR
SCHEMBL23960484 0.76 ABL1 (0.42) KIF11KCNH2ABL1ABCB1BCR
SCHEMBL9729522 0.74 BACE1 (0.50) KIF11KCNH2ABL1ABCB1BCR
SCHEMBL13336381 0.71 PIN1 (0.47) ABL1ABCB1BCRBACE1SMN1; SMN2
SCHEMBL8592606 0.71 KIF11 (0.60) KIF11KCNH2SMN1; SMN2
SCHEMBL5838167 0.71 KIF11 (0.60) KIF11KCNH2SMN1; SMN2
SCHEMBL27845746 0.70 PIN1 (0.46) ABL1ABCB1BCRBACE1SMN1; SMN2
SCHEMBL15212173 0.70 KIF11 (0.68) KIF11KCNH2SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210332070-A1 Compositions and Methods for Synthesis of Phosphorylated Molecules UNIV CALIFORNIA (US) 2021-10-28 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-20210332070-A1 Compositions and Methods for Synthesis of Phosphorylated Molecules PIK3CA, CHAMP1, TYMP KIF11 2519/4885KCNH2 3514/4885ABL1 387/4885

“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.