SCHEMBL6513804

SCHEMBL6513804

O=C(O)CC(C(=O)O)=C(CC(=O)Oc1ccccc1)C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
PKM P14618 1/20 0.44
EPHX2 P34913 1/20 0.44
POLB P06746 2/20 0.43
ELANE P08246 1/20 0.43
HPGD P15428 1/20 0.39
METAP2 P50579 1/20 0.38
METAP1 P53582 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
FAAH O00519 1/20 0.37

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
SCHEMBL6520999 0.99 RAB9A (0.43) RAB9AALDH1A1SMN1; SMN2NPC1PKM
SCHEMBL6523082 0.89 KMT2A (0.45) ALDH1A1SMN1; SMN2POLBELANEKDM4E
SCHEMBL6515227 0.87 MEN1 (0.45) ALDH1A1SMN1; SMN2POLBHPGD
SCHEMBL6514911 0.81 ALDH1A1 (0.44) RAB9AALDH1A1SMN1; SMN2NPC1HPGD
SCHEMBL6515215 0.80 ERCC5 (0.47) RAB9ASMN1; SMN2NPC1EPHX2POLB
SCHEMBL9355898 0.78 EPHX2 (0.51) ALDH1A1SMN1; SMN2EPHX2HPGDKDM4E
SCHEMBL6516332 0.78 ERCC5 (0.49) RAB9AALDH1A1SMN1; SMN2NPC1HPGD
SCHEMBL6519507 0.77 EPHX2 (0.35) SMN1; SMN2EPHX2
SCHEMBL6519195 0.76 HTT (0.41) RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL6523839 0.76 HTT (0.41) RAB9AALDH1A1SMN1; SMN2KDM4E

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 RAB9A 2333/4885ALDH1A1 1254/4885SMN1; SMN2 1768/4885

“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.