SCHEMBL6523732

SCHEMBL6523732

O=C(O)CC(C(=O)O)=C(CC(=O)C1CCCC1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
GAA P10253 2/20 0.40
HTT P42858 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
ATM Q13315 2/20 0.39
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
ALDH1A1 P00352 3/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
PTPN1 P18031 1/20 0.39
ERCC5 P28715 1/20 0.39
FEN1 P39748 1/20 0.39
POLB P06746 1/20 0.38
ELANE P08246 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL6520986 0.87 NPC1 (0.42) HPGDRAB9ASMN1; SMN2GAAALDH1A1
SCHEMBL6522172 0.80 LMNA (0.41) HPGDRAB9ASMN1; SMN2ATMALDH1A1
SCHEMBL6518212 0.80 HPGD (0.41) HPGDMTNR1AMTNR1BRAB9ASMN1; SMN2
SCHEMBL6518203 0.80 HPGD (0.41) HPGDMTNR1AMTNR1BRAB9ASMN1; SMN2
SCHEMBL9358938 0.80 HPGD (0.45) HPGDMTNR1AMTNR1BRAB9ASMN1; SMN2
SCHEMBL6515935 0.79 KDM2B (0.44) GAAATMALDH1A1LMNAPOLB
SCHEMBL6516332 0.78 ERCC5 (0.49) HPGDMTNR1AMTNR1BRAB9ASMN1; SMN2
SCHEMBL6522224 0.77 MEN1 (0.57) HPGDRAB9ASMN1; SMN2GAAALDH1A1
SCHEMBL11788960 0.77 HPGD (0.57) HPGDMTNR1AMTNR1BRAB9ASMN1; SMN2
SCHEMBL6515215 0.77 ERCC5 (0.47) HPGDRAB9ASMN1; SMN2GAAHTT

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 HPGD 4110/4885MTNR1A 2047/4885MTNR1B 2845/4885

“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.