SCHEMBL6516621

SCHEMBL6516621

O=C(CCc1ccccc1)CC(C(=O)O)C(=Cc1cccc2ccccc12)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
TRPA1 O75762 2/20 0.43
CYP1A1 P04798 1/20 0.40
CYP1B1 Q16678 1/20 0.40
TRPV1 Q8NER1 2/20 0.39
SMPD2 O60906 2/20 0.39
GPR52 Q9Y2T5 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
GAA P10253 1/20 0.38
CRHBP P24387 1/20 0.38
HTT P42858 1/20 0.38
CRHR2 Q13324 1/20 0.38
GRIK1 P39086 1/20 0.37
GRIK2 Q13002 1/20 0.37
CAPN1 P07384 2/20 0.37
CTSB P07858 1/20 0.36

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
SCHEMBL6516609 0.84 KDM4E (0.49) KDM4ESMPD2KMT2AMEN1ALDH1A1
SCHEMBL6518901 0.83 KDM4E (0.41) KDM4ESMPD2GPR52KMT2AMEN1
SCHEMBL6524361 0.80 KDM4E (0.47) KDM4ECYP1A1CYP1B1SMPD2KMT2A
SCHEMBL6520284 0.77 KDM4E (0.44) KDM4ETRPV1SMPD2KMT2AMEN1
SCHEMBL6520790 0.75 KDM4E (0.45) KDM4ESMPD2KMT2AMEN1ALDH1A1
SCHEMBL6515922 0.74 KDM4E (0.42) KDM4ESMPD2KMT2AMEN1ALDH1A1
SCHEMBL6518068 0.73 KDM4E (0.41) KDM4ESMPD2KMT2AMEN1ALDH1A1
SCHEMBL6516689 0.73 KDM4E (0.43) KDM4ESMPD2KMT2AMEN1ALDH1A1
SCHEMBL563758 0.72 KDM4E (0.51) KDM4ECYP1A1CYP1B1SMPD2KMT2A
SCHEMBL6522227 0.72 MEN1 (0.41) KDM4ESMPD2KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed
US-20030118544-A1 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-06-26 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 (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-20030118544-A1 Antifouling coating composition and novel resin COL1A1, GLRA1, COL2A1 KDM4E 329/4885TRPA1 2902/4885CYP1A1 729/4885

“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.