SCHEMBL6522201

SCHEMBL6522201

O=C(CCc1ccccc1)CC(C(=O)O)=C(C(=O)O)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 1/20 0.47
CNR1 P21554 2/20 0.46
CNR2 P34972 2/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1B1 Q16678 1/20 0.46
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
NR4A1 P22736 1/20 0.44
NR4A2 P43354 1/20 0.44
NR4A3 Q92570 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.43
SCN5A Q14524 1/20 0.43
SCN2A Q99250 1/20 0.43
DRD4 P21917 2/20 0.42
FFAR1 O14842 1/20 0.41
AKR1B1 P15121 1/20 0.41
MMP12 P39900 1/20 0.41
MMP3 P08254 1/20 0.41
HDAC8 Q9BY41 1/20 0.41

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
SCHEMBL6522193 1.00 GPR52 (0.47) GPR52CNR1CNR2CYP1A1CYP1B1
SCHEMBL6514446 0.82 NR4A1 (0.47) CNR1CNR2KDM4EALDH1A1NR4A1
SCHEMBL6514435 0.82 NR4A1 (0.47) CNR1CNR2KDM4EALDH1A1NR4A1
SCHEMBL6516628 0.82 MMP12 (0.46) GPR52CNR1CNR2CYP1A1CYP1B1
SCHEMBL6522137 0.78 NR4A1 (0.49) KDM4EALDH1A1NR4A1NR4A2NR4A3
SCHEMBL6522133 0.78 NR4A1 (0.49) KDM4EALDH1A1NR4A1NR4A2NR4A3
SCHEMBL6514730 0.73 MEN1 (0.51) KDM4EALDH1A1NR4A1NR4A2NR4A3
SCHEMBL6514725 0.73 MEN1 (0.51) KDM4EALDH1A1NR4A1NR4A2NR4A3
SCHEMBL6523595 0.72 PTPN1 (0.51) KDM4EALDH1A1NR4A1NR4A2NR4A3
SCHEMBL6523586 0.72 PTPN1 (0.51) KDM4EALDH1A1NR4A1NR4A2NR4A3

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 GPR52 2240/4885CNR1 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.