SCHEMBL24910469

SCHEMBL24910469

CC(C)(C)c1cc(Cl)c(Cl)cc1C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.45
CYP2C9 P11712 3/20 0.45
TP53 P04637 3/20 0.45
CYP2C19 P33261 2/20 0.45
HIF1A Q16665 1/20 0.45
ALDH1A1 P00352 4/20 0.43
ALOX15 P16050 4/20 0.43
CYP1A2 P05177 2/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ATP2A2 P16615 1/20 0.43
ATP2A3 Q93084 1/20 0.43
CA2 P00918 4/20 0.39
CA1 P00915 2/20 0.39
TYR P14679 2/20 0.38
POLB P06746 1/20 0.38
AHR P35869 3/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 2/20 0.35
LMNA P02545 2/20 0.35

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
SCHEMBL12733032 0.88 SMN1; SMN2 (0.42) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL31497679 0.87 SMN1; SMN2 (0.45) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL19997077 0.87 SMN1; SMN2 (0.38) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL12162725 0.83 SMN1; SMN2 (0.44) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL15701548 0.81 SMN1; SMN2 (0.38) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL16117670 0.81 ALDH1A1 (0.67) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL19163700 0.81 SMN1; SMN2 (0.38) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL12933506 0.81 GAA (0.46) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL7132801 0.78 ALDH1A1 (0.53) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A
SCHEMBL13911912 0.78 ALDH1A1 (0.41) SMN1; SMN2CYP2C9TP53CYP2C19HIF1A

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-20230019280-A1 SUBSTITUTED ISOINDOLONYL 2,2'-BIPYRIMIDINYL COMPOUNDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2023-01-19 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-20230019280-A1 SUBSTITUTED ISOINDOLONYL 2,2'-BIPYRIMIDINYL COMPOUNDS, ANALOGUES THEREOF, AND METHODS USING SAME HAVCR2, CDV3, HCCS SMN1; SMN2 4152/4885CYP2C9 491/4885TP53 102/4885

“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.