SCHEMBL23914097

SCHEMBL23914097

C=C1C(=O)O[C@H](C2CCCCC2)[C@@H]1c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 2/20 0.39
▸ GAA P10253 1/20 0.36
▸ HDAC4 P56524 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HPGD P15428 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SLC18A3 Q16572 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ ACHE P22303 1/20 0.32

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
SCHEMBL23914323 1.00 CYP19A1 (0.39) CYP19A1GAAHDAC4NPSR1HPGD
SCHEMBL23914093 0.87 CYP19A1 (0.42) CYP19A1SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL23914092 0.87 CYP19A1 (0.42) CYP19A1SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL23913983 0.72 SMN1; SMN2 (0.39) CYP19A1SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6980797 0.72 SMN1; SMN2 (0.40) GAAHDAC4NPSR1SMN1; SMN2MEN1
SCHEMBL5442142 0.72 SMN1; SMN2 (0.39) CYP19A1SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL23914451 0.72 SMN1; SMN2 (0.39) CYP19A1SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL23913984 0.72 SMN1; SMN2 (0.39) CYP19A1SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL23914452 0.72 SMN1; SMN2 (0.39) CYP19A1SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL14427618 0.72 SMN1; SMN2 (0.39) CYP19A1SMN1; SMN2MEN1ALDH1A1KMT2A

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-20210317099-A1 SAFER, POTENT, AND FAST ACTING ANTIMICROBIAL AGENTS PURDUE RESEARCH FOUNDATION (US) 2021-10-14 — — 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-20210317099-A1 SAFER, POTENT, AND FAST ACTING ANTIMICROBIAL AGENTS MIF, LTA, MGAM CYP19A1 2911/4885GAA 2417/4885HDAC4 1439/4885

“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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