SCHEMBL25625627

SCHEMBL25625627

Cn1cc(F)c2cc(C(C)(C)C)c(OCCN3CCOCC3)nc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ SIGMAR1 Q99720 3/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ SYK P43405 1/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ GUCY1B2 O75343 1/20 0.36
▸ GUCY1A2 P33402 1/20 0.36
▸ GUCY1A1 Q02108 1/20 0.36
▸ GUCY1B1 Q02153 1/20 0.36
▸ KDM4E B2RXH2 2/20 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
SCHEMBL25624610 0.80 CYP3A4 (0.42) CYP3A4CYP2D6SIGMAR1KMT2AMEN1
SCHEMBL25613066 0.74 CYP3A4 (0.46) CYP3A4CYP2D6SIGMAR1KMT2AMEN1
SCHEMBL25624353 0.74 SCN9A (0.30) —
SCHEMBL25613068 0.72 CYP3A4 (0.45) CYP3A4CYP2D6SIGMAR1KMT2AMEN1
SCHEMBL24714753 0.71 GUCY1B2 (0.45) CYP3A4CYP2D6SIGMAR1KMT2AMEN1
SCHEMBL25627478 0.70 CYP2D6 (0.43) CYP3A4CYP2D6SIGMAR1KMT2AMEN1
SCHEMBL25624526 0.70 CYP2C19 (0.40) CYP2D6ALDH1A1SMN1; SMN2KDM4E
SCHEMBL24351449 0.67 SYK (0.45) SIGMAR1KMT2AMEN1ALDH1A1LMNA
SCHEMBL22962823 0.67 SYK (0.48) CYP3A4CYP2D6KMT2AMEN1ALDH1A1
SCHEMBL20347952 0.65 KDM4E (0.55) SIGMAR1ALDH1A1POLBSMN1; SMN2KDM4E

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 CYP3A4 3544/4885CYP2D6 3553/4885SIGMAR1 4271/4885

“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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