SCHEMBL27271007

SCHEMBL27271007

CC(C)NC(Cc1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
THRB P10828 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MME P08473 7/20 0.49
ACE P12821 3/20 0.49
CPA1 P15085 3/20 0.49
ACE2 Q9BYF1 3/20 0.49
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP14 P50281 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
MMP1 P03956 2/20 0.45

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
SCHEMBL23306982 0.93 MME (0.52) MMEACECPA1ACE2MMP9
SCHEMBL29311610 0.90 MME (0.47) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL17943265 0.89 NPC1 (0.50) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL12766328 0.89 NPC1 (0.50) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL7601946 0.89 NPC1 (0.50) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL18435193 0.88 NPC1 (0.53) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL19795789 0.88 ALDH1A1 (0.55) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL18435393 0.88 NPC1 (0.53) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL29311759 0.87 ALDH1A1 (0.51) ALDH1A1THRBCYP2C9CYP2C19HSD17B10
SCHEMBL27268112 0.87 MMP2 (0.52) ALDH1A1THRBCYP2C9CYP2C19HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228671-A1 POLYPEPTIDYL LINKERS Quantum-Si Incorporated (US) 2024-07-11 US disclosed
US-20240228671-A1 POLYPEPTIDYL LINKERS Quantum-Si Incorporated (US) 2024-07-11 US disclosed
WO-2024086826-A2 POLYPEPTIDYL LINKERS Quantum-Si Incorporated (US) 2024-04-25 WO 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-20240228671-A1 POLYPEPTIDYL LINKERS VIP, DNPEP, PREP ALDH1A1 1569/4885THRB 3089/4885CYP2C9 1226/4885

“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.