SCHEMBL25624526

SCHEMBL25624526

CC(C)(C)c1cc2c(F)c[nH]c2nc1OCCN1CCC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ KDM4E B2RXH2 4/20 0.36
▸ HTT P42858 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ HRH3 Q9Y5N1 4/20 0.34
▸ PSMB1 P20618 2/20 0.33
▸ PSMB5 P28074 2/20 0.33
▸ PSMB2 P49721 2/20 0.33
▸ LTA4H P09960 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HTR6 P50406 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33

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
SCHEMBL25624610 0.90 CYP3A4 (0.42) CYP2D6ALDH1A1
SCHEMBL25613052 0.88 ALDH1A1 (0.44) CYP2C19CYP1A2CYP2D6HSD17B10ALDH1A1
SCHEMBL25627483 0.86 CYP1A2 (0.33) CYP2C19CYP1A2CYP2D6HSD17B10ALDH1A1
SCHEMBL24005907 0.83 LTA4H (0.35) HRH3LTA4HHTR6KCNH2
SCHEMBL25624434 0.81 MERTK (0.35) —
SCHEMBL25624362 0.80 CDK1 (0.34) —
SCHEMBL25613066 0.78 CYP3A4 (0.46) CYP2D6ALDH1A1SMN1; SMN2
SCHEMBL25613054 0.78 LTA4H (0.45) CYP2C19CYP1A2CYP2D6HSD17B10ALDH1A1
SCHEMBL25627364 0.77 MAP3K7 (0.33) CYP2C19CYP1A2L3MBTL1
SCHEMBL25626737 0.75 LRRK2 (0.34) —

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-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON BIOSCIENCES, LTD. (CN) 2023-05-25 — — 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-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS BCL2, BCL2L2, BCL2L1 CYP2C19 3647/4885CYP1A2 2573/4885CYP2D6 3553/4885

“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.

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