SCHEMBL30167976

SCHEMBL30167976

COc1ccc(C(N[C@@H](C)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 7/20 0.48
OPRM1 P35372 1/20 0.48
OPRD1 P41143 1/20 0.48
ATM Q13315 1/20 0.48
PTPN1 P18031 1/20 0.47
FPR2 P25090 1/20 0.47
FCER2 P06734 3/20 0.46
MMP3 P08254 3/20 0.46
MMP9 P14780 2/20 0.46
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
HSD17B10 Q99714 1/20 0.44
REN P00797 1/20 0.43
POLB P06746 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL30167978 0.85 PTPN1 (0.46) MMP1OPRM1OPRD1ATMPTPN1
SCHEMBL30167975 0.84 PTPN1 (0.45) MMP1OPRM1OPRD1ATMPTPN1
SCHEMBL29964895 0.83 MMP3 (0.44) MMP1MMP3MMP9KMT2AALDH1A1
SCHEMBL29965298 0.83 OPRD1 (0.49) OPRM1OPRD1PTPN1
SCHEMBL17542012 0.81 KIF11 (0.48) KMT2AALDH1A1
SCHEMBL17542010 0.81 KIF11 (0.48) KMT2AALDH1A1
SCHEMBL29964886 0.79 ALDH1A1 (0.42) MMP1OPRM1OPRD1ATMMMP3
SCHEMBL30990575 0.78 CCKBR (0.49) PTPN1REN
SCHEMBL30100119 0.77 FPR2 (0.50) FPR2MMP3KMT2AALDH1A1
SCHEMBL29964989 0.76 KIF11 (0.50) KMT2AALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548913-B2 Therapeutic compositions including peptides and uses thereof STEALTH BIOTHERAPEUTICS INC. (US) 2023-01-10 US claimed
US-11548913-B2 Therapeutic compositions including peptides and uses thereof STEALTH BIOTHERAPEUTICS INC. (US) 2023-01-10 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-11548913-B2 Therapeutic compositions including peptides and uses thereof VIP, IAPP, TNNI3 MMP1 521/4885OPRM1 2534/4885OPRD1 3399/4885

“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.