SCHEMBL23914092

SCHEMBL23914092

C=C1C(=O)OC(C2CCCCC2)[C@@H]1c1ccc(C)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 3/20 0.42
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ CYP3A4 P08684 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ CCR1 P32246 4/20 0.33
▸ ADCY2 Q08462 1/20 0.33
▸ CCR2 P41597 3/20 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
SCHEMBL23914093 1.00 CYP19A1 (0.42) CYP19A1MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL23914323 0.87 CYP19A1 (0.39) CYP19A1MAPTALDH1A1SMN1; SMN2KMT2A
SCHEMBL23914097 0.87 CYP19A1 (0.39) CYP19A1MAPTALDH1A1SMN1; SMN2KMT2A
SCHEMBL23914349 0.75 ALDH1A1 (0.39) CYP19A1MAPTLMNAALDH1A1ATM
SCHEMBL3941375 0.72 CYP19A1 (0.43) CYP19A1MAPTLMNAALDH1A1TP53
SCHEMBL23914087 0.71 MAOB (0.41) CYP19A1MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL23914439 0.71 MAOB (0.41) CYP19A1MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL3949405 0.68 CYP19A1 (0.40) CYP19A1
SCHEMBL23913793 0.67 ACHE (0.44) MAPTLMNAALDH1A1SMN1; SMN2TP53
SCHEMBL23914279 0.66 ALDH1A1 (0.46) CYP19A1ALDH1A1

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 2911/4885MAPT 3922/4885LMNA 1955/4885

“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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