SCHEMBL23055696

SCHEMBL23055696

CC(C)NC(=O)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.71
CYP3A4 P08684 2/20 0.71
CYP2C9 P11712 2/20 0.71
CYP2D6 P10635 1/20 0.71
TSHR P16473 1/20 0.71
PMP22 Q01453 1/20 0.71
HIF1A Q16665 1/20 0.71
NPSR1 Q6W5P4 1/20 0.71
KDM4E B2RXH2 1/20 0.54
CNR1 P21554 6/20 0.50
PTGER4 P35408 2/20 0.48
LMNA P02545 2/20 0.46
CYP2C19 P33261 1/20 0.46
CNR2 P34972 4/20 0.46
PTGER1 P34995 1/20 0.45
SLC9A1 P19634 1/20 0.45
PPARG P37231 1/20 0.45
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL21526161 0.89 CYP1A2 (0.62) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526160 0.89 CYP1A2 (0.62) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL31016975 0.89 CYP1A2 (0.62) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21553419 0.89 CYP1A2 (0.67) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526162 0.88 CNR1 (0.67) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526163 0.88 CNR1 (0.67) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL24486720 0.88 CYP1A2 (0.75) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526174 0.88 CYP1A2 (0.60) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL21526173 0.88 CYP1A2 (0.60) CYP1A2CYP3A4CYP2C9CYP2D6TSHR
SCHEMBL31016972 0.88 CYP1A2 (0.60) CYP1A2CYP3A4CYP2C9CYP2D6TSHR

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-20210061830-A1 MITO-LONIDAMINE, COMPOSITIONS AND METHODS OF USE AIX-MARSEILLE UNIVERSITE (FR) 2021-03-04 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-20210061830-A1 MITO-LONIDAMINE, COMPOSITIONS AND METHODS OF USE COX5B, COX5A, LONP1 CYP1A2 613/4885CYP3A4 807/4885CYP2C9 398/4885

“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.