SCHEMBL24617136

SCHEMBL24617136

CC(C)(C)c1ccc(-c2ccc3cc(C#N)ccc3c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.70
CYP11B1 P15538 2/20 0.50
CYP11B2 P19099 2/20 0.50
CYP17A1 P05093 1/20 0.50
HRH3 Q9Y5N1 7/20 0.49
CSNK1D P48730 4/20 0.45
CSNK1G2 P78368 3/20 0.45
CSNK1A1 P48729 1/20 0.45
GSK3B P49841 1/20 0.45
CCR9 P51686 1/20 0.43
PGR P06401 1/20 0.43
PTPN5 P54829 1/20 0.39
EPHX2 P34913 1/20 0.39

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
SCHEMBL18118556 0.90 KIF11 (0.70) KIF11CYP11B1CYP11B2CYP17A1HRH3
SCHEMBL19798867 0.85 KIF11 (0.57) KIF11CYP11B1CYP11B2CYP17A1CSNK1D
SCHEMBL3421538 0.83 KIF11 (1.00) KIF11CYP11B2CSNK1DCSNK1G2CSNK1A1
SCHEMBL3420933 0.83 KIF11 (1.00) KIF11CYP11B2CSNK1DCSNK1G2CSNK1A1
SCHEMBL25708841 0.81 KIF11 (0.53) KIF11CYP11B1CYP11B2CYP17A1HRH3
SCHEMBL13761675 0.81 KIF11 (0.67) KIF11PGRPTPN5
SCHEMBL24617134 0.81 KIF11 (0.79) KIF11CYP11B2HRH3PTPN5EPHX2
SCHEMBL13350234 0.80 ALDH1A1 (0.56) KIF11CYP11B1CYP11B2CYP17A1HRH3
SCHEMBL19656644 0.80 KIF11 (0.55) KIF11CYP11B1CYP11B2CSNK1DCSNK1G2
SCHEMBL5477144 0.79 CYP11B1 (0.61) CYP11B1CYP11B2CYP17A1HRH3PGR

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-20220220084-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2022-07-14 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-20220220084-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC APPARATUS EXOC4, CYBA, SCO2 KIF11 3243/4885CYP11B1 1032/4885CYP11B2 495/4885

“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.