SCHEMBL6905321

SCHEMBL6905321

CCCCCCCCCCCCc1ccc(C(=O)C=CC(=O)O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATG4B Q9Y4P1 12/20 1.00
PLA2G1B P04054 10/20 1.00
THRA P10827 6/20 1.00
THRB P10828 6/20 1.00
CYP1A2 P05177 1/20 1.00
TDP1 Q9NUW8 1/20 1.00
RECQL P46063 1/20 1.00
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68

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
SCHEMBL6905318 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL16225997 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL16226604 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL8984288 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL8984283 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL16226603 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL16226350 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL15536727 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL16226164 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2
SCHEMBL16226351 1.00 ATG4B (1.00) ATG4BPLA2G1BTHRATHRBCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995002714-A1 AGENTS FOR THE CLEANING AND PASSIVATION OF METAL SURFACES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1995-01-26 WO claimed
US-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 US disclosed
US-6705142-B1 Metal shaping process using a novel two phase cooling lubricant system HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-03-16 US disclosed
WO-1995002712-A2 USE OF CARBOXYLIC ACIDS IN AGENTS FOR THE TREATMENT OF METAL SURFACES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1995-01-26 WO disclosed
WO-1995002714-A1 AGENTS FOR THE CLEANING AND PASSIVATION OF METAL SURFACES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1995-01-26 WO disclosed
EP-0494884-B1 PROCESS FOR MANUFACTURING STABLE, LOW-VISCOSITY OW ANTI-RUST EMULSIONS HENKEL KGAA (DE) 1994-11-23 EP disclosed
US-5230730-A Storage stable oil in water emulsion with emulsifiers of nonionic fatty alcohol polyethers and carboxylic acids HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1993-07-27 US disclosed
EP-0494884-A1 PROCESS FOR MANUFACTURING STABLE, LOW-VISCOSITY OW ANTI-RUST EMULSIONS. HENKEL KGAA (DE) 1992-07-22 EP disclosed
WO-1991005033-A1 PROCESS FOR MANUFACTURING STABLE, LOW-VISCOSITY OW ANTI-RUST EMULSIONS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1991-04-18 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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER IL2RA, CD74, IL2 ATG4B 4484/4885PLA2G1B 2591/4885THRA 26/4885

“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.