SCHEMBL10078064

SCHEMBL10078064

CC(=O)C(Cc1ccc(O)cc1)NC(C)C

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.53
ESR2 Q92731 3/20 0.53
FOLH1 Q04609 1/20 0.50
SLC7A5 Q01650 1/20 0.47
TAAR1 Q96RJ0 3/20 0.47
SLC6A2 P23975 1/20 0.47
ACE P12821 3/20 0.46
MME P08473 3/20 0.46
CPA1 P15085 1/20 0.46
ACE2 Q9BYF1 1/20 0.46
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NAALAD2 Q9Y3Q0 1/20 0.43
TSHR P16473 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 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
SCHEMBL23306918 0.89 ACE (0.50) ESR1ESR2FOLH1ACEMME
SCHEMBL12894465 0.88 ACE (0.52) ESR1ESR2FOLH1SLC7A5TAAR1
SCHEMBL12869808 0.86 FOLH1 (0.61) FOLH1SLC7A5ACEMMECPA1
SCHEMBL5738141 0.86 FOLH1 (0.61) FOLH1SLC7A5ACEMMECPA1
SCHEMBL13356097 0.85 ACE (0.49) ESR1ESR2FOLH1SLC7A5TAAR1
SCHEMBL684443 0.85 ACACB (0.49) SLC6A2GAASMN1; SMN2
SCHEMBL13323478 0.85 ACACB (0.49) SLC6A2GAASMN1; SMN2
SCHEMBL7601953 0.85 FOLH1 (0.49) ESR1ESR2FOLH1SLC7A5TAAR1
SCHEMBL23306932 0.85 NPC1 (0.43) ESR1ESR2MME
SCHEMBL27250348 0.85 FOLH1 (0.49) ESR1ESR2FOLH1SLC7A5TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024149845-A1 METHODS FOR CELL SURFACE REMODELING NANTES UNIVERSITÉ (FR) 2024-07-18 WO disclosed
US-20230183253-A1 NANOMATERIAL COMPOSITIONS, SYNTHESIS, AND ASSEMBLY RHODE ISLAND HOSPITAL 2023-06-15 US disclosed
US-20210121585-A1 PSMA targeted radiotherapy medicine and preparation method thereof LI MING HSIN (TW) 2021-04-29 US disclosed
US-20200361944-A1 FRAGMENT SYNTHESIS OF CYCLIC PEPTIDES ZEALAND PHARMA A/S (DK) 2020-11-19 US disclosed
US-20170362238-A1 NANOMATERIAL COMPOSITIONS, SYNTHESIS, AND ASSEMBLY RHODE ISLAND HOSPITAL 2017-12-21 US disclosed
US-20120021029-A1 PEPTIDES USED IN THE TREATMENT AND/OR CARE OF THE SKIN AND/OR HAIR AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS LIPOTEC, S.A. (ES) 2012-01-26 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 (5 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-20120021029-A1 PEPTIDES USED IN THE TREATMENT AND/OR CARE OF THE SKIN AND/OR HAIR AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS NGLY1, MC1R, NPR3 ESR1 4227/4885ESR2 2250/4885FOLH1 695/4885
US-20170362238-A1 NANOMATERIAL COMPOSITIONS, SYNTHESIS, AND ASSEMBLY POLRMT, NT5C3B, CHMP4B ESR1 4240/4885ESR2 4222/4885FOLH1 1198/4885
US-20210121585-A1 PSMA targeted radiotherapy medicine and preparation method thereof FOLH1, KLK3, PSMA1 ESR1 673/4885ESR2 1107/4885FOLH1 1/4885
US-20200361944-A1 FRAGMENT SYNTHESIS OF CYCLIC PEPTIDES VIP, NPPA, NGLY1 ESR1 4524/4885ESR2 2631/4885FOLH1 109/4885
US-20230183253-A1 NANOMATERIAL COMPOSITIONS, SYNTHESIS, AND ASSEMBLY POLRMT, NT5C3B, CHMP4B ESR1 4240/4885ESR2 4222/4885FOLH1 1198/4885

“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.