SCHEMBL6518901

SCHEMBL6518901

O=C(CC(C(=O)O)C(=Cc1cccc2ccccc12)C(=O)O)OCCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
HCAR2 Q8TDS4 1/20 0.40
ALOX5 P09917 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMPD2 O60906 2/20 0.37
AKR1B10 O60218 2/20 0.36
AKR1B1 P15121 2/20 0.36
APP P05067 1/20 0.36
GPR52 Q9Y2T5 1/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
CRHBP P24387 1/20 0.36
HTT P42858 1/20 0.36
CRHR2 Q13324 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
SCHEMBL6518068 0.86 KDM4E (0.41) KDM4ECNR1CNR2TDP1SMPD2
SCHEMBL6516621 0.83 KDM4E (0.43) KDM4ESMPD2AKR1B1GPR52KMT2A
SCHEMBL6520284 0.81 KDM4E (0.44) KDM4ETDP1SMPD2KMT2AALDH1A1
SCHEMBL6524361 0.77 KDM4E (0.47) KDM4ESMPD2KMT2AALDH1A1HPGD
SCHEMBL6516689 0.77 KDM4E (0.43) KDM4ETDP1SMPD2KMT2AALDH1A1
SCHEMBL6516609 0.76 KDM4E (0.49) KDM4ESMPD2AKR1B1KMT2AALDH1A1
SCHEMBL6522227 0.76 MEN1 (0.41) KDM4ESMPD2KMT2AALDH1A1HPGD
SCHEMBL6520790 0.73 KDM4E (0.45) KDM4ESMPD2KMT2AALDH1A1HPGD
SCHEMBL6515922 0.72 KDM4E (0.42) KDM4ECNR1SMPD2KMT2AALDH1A1
SCHEMBL6520990 0.71 ALDH1A1 (0.43) KDM4ETDP1KMT2AALDH1A1HPGD

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 329/4885CNR1 1021/4885CNR2 2242/4885

“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.