SCHEMBL6515868

SCHEMBL6515868

C=C(C(=O)O)C(C(=O)O)(C(C)C(=O)OCCOc1ccccc1)C(C)C(=O)OCCOc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.47
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 1/20 0.43
PKM P14618 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
KMT2A Q03164 1/20 0.41
RELA Q04206 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 1/20 0.40
PPARA Q07869 1/20 0.40
PARP10 Q53GL7 1/20 0.39
PPARG P37231 2/20 0.39

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
SCHEMBL6518595 0.90 L3MBTL1 (0.44) NPC1ALDH1A1HPGDKDM4EMEN1
SCHEMBL6519676 0.85 ATM (0.45) RAB9ANPC1TSHRALDH1A1MEN1
SCHEMBL6523827 0.82 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1MEN1KMT2APPARA
SCHEMBL6523971 0.80 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1KMT2ATDP1LMNA
SCHEMBL6524297 0.79 TSHR (0.31) TSHR
SCHEMBL6516171 0.75 LMNA (0.47) RAB9ASMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL6520848 0.75 KMT2A (0.44) RAB9AALDH1A1KDM4EMEN1KMT2A
SCHEMBL6520315 0.75 THRB (0.33) THRBHSD17B10
SCHEMBL9180568 0.75 THRB (0.57) THRBRAB9ANPC1SMN1; SMN2TSHR
SCHEMBL1871138 0.75 THRB (0.57) THRBRAB9ANPC1SMN1; SMN2TSHR

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 THRB 3136/4885RAB9A 2333/4885NPC1 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.