SCHEMBL6461552

SCHEMBL6461552

Cc1ccc(CC(Cl)CC(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
FFAR1 O14842 5/20 0.45
CPA1 P15085 2/20 0.42
CPB1 P15086 1/20 0.42
CPA3 P15088 1/20 0.42
CPB2 Q96IY4 1/20 0.42
LMNA P02545 1/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
PSMB8 P28062 1/20 0.40
PSMB5 P28074 1/20 0.40
ACACB O00763 1/20 0.40
CTBP2 P56545 1/20 0.40
SRD5A2 P31213 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
SCHEMBL11830881 0.85 PTGS1 (0.53) LMNA
SCHEMBL11838196 0.85 ALDH1A1 (0.47) KMT2AMEN1PPARGPPARACPA1
SCHEMBL6461555 0.83 MME (0.50) KMT2AMEN1PPARGPPARACPA1
SCHEMBL6465862 0.82 CPA3 (0.60) FFAR1CPA1CPB1CPA3CPB2
SCHEMBL6462189 0.82 FFAR1 (0.46) KMT2AMEN1FFAR1
SCHEMBL11829530 0.82 PTGS1 (0.46) KMT2AMEN1FFAR1LMNAACACB
SCHEMBL6461540 0.81 LDHA (0.62) KMT2APPARGPPARAFFAR1
SCHEMBL11827853 0.81 TP53 (0.47) KMT2AMEN1FFAR1ACACB
SCHEMBL11833051 0.80 ABCC4 (0.58) PPARGPPARAFFAR1CPA1CPB1
SCHEMBL11828222 0.80 CTBP2 (0.45) FFAR1CPA1CPB1CPA3CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6903233-B2 Process for producing optically active 3-halogenocarboxylic acid ester and 3-azidocarboxylic acid ester TAKASAGO INTERNATIONAL CORPORATION (JP) 2005-06-07 US disclosed
US-20030225301-A1 Process for producing optically active 3-halogenocarboxylic acid ester and 3-azidocarboxylic acid ester TAKASAGO INTERNATIONAL CORPORATION (JP) 2003-12-04 US disclosed
EP-1344763-A1 Process for producing optically active 3-halogenocarboxylic acid esters and 3-azide-carboxylic acid esters Takasago International Corporation (JP) 2003-09-17 EP disclosed
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 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-20030225301-A1 Process for producing optically active 3-halogenocarboxylic acid ester and 3-azidocarboxylic acid ester HDHD5, APEH, AOC3 KMT2A 2065/4885MEN1 2962/4885PPARG 2174/4885

“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.