SCHEMBL2807016

SCHEMBL2807016

O=C(O)CCc1ccccc1CC(=O)NCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.45
KEAP1 Q14145 1/20 0.44
PTGER1 P34995 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 1/20 0.43
PTGER2 P43116 1/20 0.43
MAPT P10636 1/20 0.43
FFAR1 O14842 5/20 0.42
TAAR1 Q96RJ0 1/20 0.41
ALDH1A1 P00352 1/20 0.41
FFAR4 Q5NUL3 2/20 0.41
ABAT P80404 1/20 0.40
EPHX2 P34913 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL29415449 0.87 ATM (0.53) ATMKEAP1PTGER1PTGER4PTGER3
SCHEMBL2804428 0.87 ATM (0.53) ATMKEAP1PTGER1PTGER4PTGER3
SCHEMBL8277241 0.81 L3MBTL1 (0.53) ATMTAAR1ALDH1A1ABATMEN1
SCHEMBL6427246 0.81 AKR1B1 (0.62) ABATMEN1NPC1RAB9AKMT2A
SCHEMBL8019696 0.80 AKR1B1 (0.59) KEAP1PTGER1PTGER4PTGER3PTGER2
SCHEMBL59198 0.80 KEAP1 (0.65) KEAP1PTGER1PTGER4PTGER3PTGER2
SCHEMBL13690071 0.79 KMT2A (0.42) TAAR1ALDH1A1ABATMEN1NPC1
SCHEMBL11802673 0.78 MME (0.43) MAPTALDH1A1ABATMEN1NPC1
SCHEMBL5294169 0.78 AKR1B1 (0.54) ALDH1A1MEN1NPC1RAB9AKMT2A
SCHEMBL31672975 0.77 AKR1B1 (0.52) TAAR1ALDH1A1ABAT

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-8968711-B2 Cosmetic or dermatological composition comprising a polymer bearing junction groups, and cosmetic treatment process L'OREAL (FR) 2015-03-03 US claimed
US-20100239509-A1 COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING A POLYMER BEARING JUNCTION GROUPS, AND COSMETIC TREATMENT PROCESS L'OREAL (FR) 2010-09-23 US claimed
WO-2018119500-A1 VISCOELASTIC COSMETIC COMPOSITIONS L'OREAL (FR) 2018-07-05 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-20100239509-A1 COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING A POLYMER BEARING JUNCTION GROUPS, AND COSMETIC TREATMENT PROCESS CUTA, SUCLG1, KRT18 ATM 1985/4885KEAP1 3517/4885PTGER1 1672/4885

“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.