SCHEMBL23960484

SCHEMBL23960484

COc1ccc(C(c2ccc(OC)cc2)(c2ccc(-c3cc(OC)ccc3C(c3ccccc3)(c3ccccc3)C(C)C)cc2)C(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.42
ABCB1 P08183 1/20 0.42
BCR P11274 1/20 0.42
BACE1 P56817 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.38
ACACA Q13085 1/20 0.38
KIF11 P52732 7/20 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
SYK P43405 1/20 0.37
KCNH2 Q12809 1/20 0.37
PIN1 Q13526 1/20 0.36
GPR84 Q9NQS5 1/20 0.36
CYP17A1 P05093 1/20 0.36
CYP3A4 P08684 1/20 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
SCHEMBL10179183 0.82 CA4 (0.50) KIF11KCNH2
SCHEMBL10173286 0.82 CA4 (0.50) KIF11KCNH2
SCHEMBL10310990 0.76 KIF11 (0.54) KIF11KCNH2
SCHEMBL23960443 0.76 KIF11 (0.46) ABL1ABCB1BCRBACE1SMN1; SMN2
SCHEMBL13347465 0.75 CA1 (0.52) KDM4ECYP17A1CYP3A4
SCHEMBL22021415 0.75 ESR2 (0.48) BACE1KIF11KCNH2CYP3A4
SCHEMBL23426239 0.75 KIF11 (0.43) KIF11KCNH2
SCHEMBL18288607 0.74 KIF11 (0.47) SMN1; SMN2KIF11KCNH2
SCHEMBL22278846 0.73 KIF11 (0.41) KIF11KCNH2
SCHEMBL13336381 0.71 PIN1 (0.47) ABL1ABCB1BCRBACE1SMN1; 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-11858953-B2 Compositions and methods for synthesis of phosphorylated molecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-01-02 US disclosed
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 (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-11858953-B2 Compositions and methods for synthesis of phosphorylated molecules PIK3CA, CHAMP1, TYMP ABL1 387/4885ABCB1 2416/4885BCR 2289/4885
US-20210332070-A1 Compositions and Methods for Synthesis of Phosphorylated Molecules PIK3CA, CHAMP1, TYMP ABL1 387/4885ABCB1 2416/4885BCR 2289/4885

“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.