SCHEMBL6525867

SCHEMBL6525867

C=C(CC(=O)OCC(=O)OCCOc1ccccc1)C(=O)OCC(=O)OCCOc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.52
NPC1 O15118 5/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TSHR P16473 1/20 0.52
THRB P10828 1/20 0.50
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
PKM P14618 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 1/20 0.43
PARP10 Q53GL7 1/20 0.42
ALOX15 P16050 1/20 0.41

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
SCHEMBL9840757 0.91 THRB (0.55) RAB9ANPC1SMN1; SMN2TSHRTHRB
SCHEMBL6520424 0.86 KDM4E (0.46) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL15122553 0.84 MEN1 (0.49) RAB9ANPC1SMN1; SMN2TSHRTHRB
SCHEMBL22615938 0.84 ALOX15 (0.47) RAB9ANPC1SMN1; SMN2TSHRTHRB
SCHEMBL6522455 0.84 CYP19A1 (0.40) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL6518132 0.82 TDP1 (0.45) RAB9ANPC1SMN1; SMN2LMNAALDH1A1
SCHEMBL6513722 0.82 SMN1; SMN2 (0.43) RAB9ANPC1SMN1; SMN2TSHRLMNA
SCHEMBL9840755 0.82 THRB (0.55) RAB9ANPC1SMN1; SMN2TSHRTHRB
SCHEMBL6518687 0.81 TSHR (0.40) RAB9ANPC1SMN1; SMN2TSHRTHRB
SCHEMBL6518846 0.81 TSHR (0.40) RAB9ANPC1SMN1; SMN2TSHRTHRB

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 2333/4885NPC1 3563/4885SMN1; 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.