SCHEMBL6521080

SCHEMBL6521080

C=C(CC(=O)OC1CCCCCCC1)C(=O)OCC(=O)c1ccc(C)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
KMT2A Q03164 1/20 0.41
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
MAPT P10636 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
POLB P06746 1/20 0.39
CXCR1 P25024 1/20 0.39
CXCR2 P25025 1/20 0.39
LMNA P02545 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
SCHEMBL6519526 1.00 ALDH1A1 (0.42) ALDH1A1KMT2ANPC1RAB9AMAPT
SCHEMBL6515212 0.88 ALDH1A1 (0.43) ALDH1A1KMT2ARAB9AMAPTCYP1A2
SCHEMBL6516328 0.87 MEN1 (0.44) ALDH1A1KMT2ANPC1RAB9AMAPT
SCHEMBL6520666 0.85 NPC1 (0.42) ALDH1A1KMT2ANPC1RAB9AMAPT
SCHEMBL6523080 0.85 GAA (0.40) KMT2ANPC1RAB9AMAPTHPGD
SCHEMBL6519446 0.81 LMNA (0.39) ALDH1A1KMT2ANPC1RAB9AMAPT
SCHEMBL6518785 0.81 NPC1 (0.50) ALDH1A1KMT2ANPC1RAB9AMAPT
SCHEMBL6519192 0.79 CYP2C19 (0.41) ALDH1A1MAPTSMN1; SMN2HPGDCYP2C19
SCHEMBL6523837 0.79 CYP2C19 (0.41) ALDH1A1MAPTSMN1; SMN2HPGDCYP2C19
SCHEMBL6520860 0.79 NAAA (0.42) ALDH1A1KMT2ASMN1; SMN2CYP2C19

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 ALDH1A1 1254/4885KMT2A 1067/4885NPC1 3563/4885

“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.