SCHEMBL6520539

SCHEMBL6520539

C=C(C(=O)O)C(CC(=O)c1cccc2ccccc12)(C(=O)O)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.43
CNR2 P34972 5/20 0.42
ALDH1A1 P00352 4/20 0.41
MAPT P10636 4/20 0.41
KDM4E B2RXH2 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NR4A1 P22736 1/20 0.40
NR4A2 P43354 1/20 0.40
NR4A3 Q92570 1/20 0.40
CNR1 P21554 4/20 0.40
PTK2B Q14289 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 3/20 0.39
LMNA P02545 3/20 0.39
POLB P06746 3/20 0.39
MEN1 O00255 2/20 0.39
GMNN O75496 2/20 0.39
MAPK1 P28482 2/20 0.39
BLM P54132 2/20 0.39
PMP22 Q01453 2/20 0.39

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
SCHEMBL6515201 0.82 KEAP1 (0.41) PTPN1ALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL6516322 0.81 KEAP1 (0.42) PTPN1ALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL6525889 0.78 PTPN1 (0.50) PTPN1ALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL6523480 0.76 PTPN1 (0.48) PTPN1CNR2ALDH1A1MAPTKDM4E
SCHEMBL6518022 0.75 PTPN1 (0.47) PTPN1ALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL6513794 0.74 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2L3MBTL1POLB
SCHEMBL6519518 0.74 RAB9A (0.42) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL6521072 0.74 RAB9A (0.42) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL9355892 0.74 KEAP1 (0.43) ALDH1A1KDM4ESMN1; SMN2L3MBTL1HPGD
SCHEMBL6520662 0.74 NPC1 (0.42) ALDH1A1SMN1; SMN2L3MBTL1HPGDLMNA

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 PTPN1 3105/4885CNR2 2242/4885ALDH1A1 1254/4885

“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.