SCHEMBL6514768

SCHEMBL6514768

C=C(C(=O)O)C(C(=O)O)(C(C)C(=O)OCCOCCCC)C(C)C(=O)OCCOCCCC

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 2/20 0.34
HSD17B10 Q99714 1/20 0.34
RARB P10826 1/20 0.33
HPGD P15428 1/20 0.32
ALDH1A1 P00352 1/20 0.32
THRB P10828 2/20 0.31
RECQL P46063 1/20 0.31
HCAR2 Q8TDS4 1/20 0.30
ATM Q13315 1/20 0.30
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 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
SCHEMBL6520315 0.92 THRB (0.33) HSD17B10THRB
SCHEMBL6520567 0.91 ALDH1A1 (0.39) TSHRMAPTHPGDALDH1A1HCAR2
SCHEMBL6515845 0.87 THRB (0.44) TSHRHSD17B10ALDH1A1THRB
SCHEMBL6525899 0.86 TSHR (0.45) TSHRALDH1A1HCAR2
SCHEMBL6513669 0.86 TSHR (0.45) TSHRALDH1A1HCAR2
SCHEMBL6517090 0.85 HCAR2 (0.33) HCAR2
SCHEMBL6524297 0.81 TSHR (0.31) TSHR
SCHEMBL6518789 0.79 ALDH1A1 (0.32) TSHRMAPTHSD17B10ALDH1A1MEN1
SCHEMBL6523827 0.76 SMN1; SMN2 (0.40) ALDH1A1MEN1HTTKMT2A
SCHEMBL6518595 0.74 L3MBTL1 (0.44) MAPTHPGDALDH1A1ATMMEN1

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 TSHR 3581/4885CYP3A4 3473/4885MAPT 3438/4885

“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.