SCHEMBL6523867

SCHEMBL6523867

C=C(C(=O)O)C(C(=O)O)(C(C)C(=O)OCCOCCc1ccccc1)C(C)C(=O)OCCOCCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.37
HCAR2 Q8TDS4 1/20 0.36
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
GLA P06280 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
AKR1B10 O60218 1/20 0.35

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
SCHEMBL6523827 0.90 SMN1; SMN2 (0.40) LMNASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL6523971 0.83 ALDH1A1 (0.46) TDP1HCAR2LMNASMN1; SMN2ALDH1A1
SCHEMBL6515868 0.82 THRB (0.47) TDP1LMNASMN1; SMN2KDM4ENPC1
SCHEMBL6520315 0.81 THRB (0.33) HSD17B10
SCHEMBL6524297 0.77 TSHR (0.31) TSHR
SCHEMBL6518595 0.75 L3MBTL1 (0.44) KDM4ENPC1ALDH1A1HPGDL3MBTL1
SCHEMBL6518125 0.74 TDP1 (0.45) TDP1HCAR2LMNASMN1; SMN2ESR1
SCHEMBL6519676 0.74 ATM (0.45) TDP1LMNANPC1RAB9AALDH1A1
SCHEMBL14521342 0.73 KDM4E (0.47) TDP1HCAR2LMNASMN1; SMN2ESR1
SCHEMBL16672858 0.72 HCAR2 (0.49) TDP1HCAR2LMNASMN1; SMN2ESR1

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 TDP1 1789/4885HCAR2 3143/4885LMNA 2459/4885

“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.