SCHEMBL25937066

SCHEMBL25937066

COc1ccc(NC(=O)C(=O)N(C)CCCn2ccnc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.68
▸ QPCT Q16769 3/20 0.57
▸ MAOB P27338 1/20 0.57
▸ MAPT P10636 2/20 0.54
▸ TSHR P16473 1/20 0.54
▸ GAA P10253 3/20 0.54
▸ LMNA P02545 3/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ ATM Q13315 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ TBXAS1 P24557 2/20 0.50
▸ TP53 P04637 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47

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
SCHEMBL25334713 0.81 ALDH1A1 (1.00) ALDH1A1QPCTMAOBMAPTTSHR
SCHEMBL10833712 0.77 ALDH1A1 (0.81) ALDH1A1QPCTMAOBMAPTTSHR
SCHEMBL25936786 0.75 ALDH1A1 (0.70) ALDH1A1QPCTMAOBMAPTTSHR
SCHEMBL14465644 0.73 MEN1 (0.60) ALDH1A1QPCTMAOBMAPTTSHR
SCHEMBL77178 0.73 QPCT (1.00) ALDH1A1QPCTMAOBGAASMN1; SMN2
SCHEMBL25335286 0.71 ALDH1A1 (0.78) ALDH1A1QPCTMAOBMAPTTSHR
SCHEMBL1525787 0.71 TP53 (0.70) ALDH1A1QPCTMAOBMAPTTSHR
SCHEMBL12767077 0.70 ALDH1A1 (0.89) ALDH1A1QPCTMAOBMAPTTSHR
SCHEMBL21637934 0.70 MAPT (1.00) ALDH1A1QPCTMAOBMAPTTSHR
SCHEMBL5827958 0.70 MEN1 (0.59) ALDH1A1QPCTMAOBMAPTTSHR

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-20230240960-A1 COMPOSITIONS, FORMULATIONS, AND METHODS FOR SKIN TREATMENT ODDITY LABS, LLC 2023-08-03 — — 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-20230240960-A1 COMPOSITIONS, FORMULATIONS, AND METHODS FOR SKIN TREATMENT CUTA, COL14A1, DSG1 ALDH1A1 3302/4885QPCT 2106/4885MAOB 1176/4885

“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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