SCHEMBL6520311

SCHEMBL6520311

C=C(C(=O)O)C(C)(CC(=O)OC1CCCC1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.40
HTT P42858 3/20 0.38
CYP2C19 P33261 1/20 0.36
EPHX1 P07099 3/20 0.35
CYP19A1 P11511 3/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
KDM4E B2RXH2 1/20 0.33
CACNA1B Q00975 4/20 0.32
TET2 Q6N021 1/20 0.32
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL6517217 0.84 NAAA (0.38) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL6521091 0.83 CYP2C19 (0.41) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL6513726 0.79 NAAA (0.36) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL6522368 0.78 NAAA (0.42) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL6519186 0.78 CYP2C19 (0.39) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL6523828 0.78 CYP2C19 (0.39) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL6522194 0.76 SMN1; SMN2 (0.35) SMN1; SMN2TET2MAPT
SCHEMBL6519172 0.75 NAAA (0.35) NAAAHTTCYP2C19EPHX1CYP19A1
SCHEMBL6516075 0.75 TET2 (0.38) CYP2C19TET2GAA
SCHEMBL6515193 0.75 CYP19A1 (0.40) HTTCYP19A1APOBEC3AAPOBEC3GSMN1; SMN2

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 NAAA 2110/4885HTT 3273/4885CYP2C19 2771/4885

“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.