SCHEMBL19862646

SCHEMBL19862646

C=CC(=O)OC(CCCC)C(O)C(OC(=O)C=C)C(O)C(OC(=O)C=C)C(O)CCCCCCCC(C)=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
ABCB1 P08183 1/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTPN1 P18031 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
FFAR1 O14842 1/20 0.31
PLA2G4A P47712 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
SCHEMBL20143062 0.85 TSHR (0.34) TSHRABCB1HPGDPTPN1
SCHEMBL19862647 0.84 PTPN1 (0.41) TSHRABCB1HPGDMEN1KMT2A
SCHEMBL20143369 0.81 TSHR (0.36) TSHRABCB1HPGDPTPN1FFAR1
SCHEMBL19862648 0.80 PTPN1 (0.38) TSHRABCB1HPGDMEN1KMT2A
SCHEMBL17358262 0.76 PTPN1 (0.47) TSHRABCB1HPGDMEN1KMT2A
SCHEMBL19862650 0.75 TSHR (0.33) TSHRABCB1HPGD
SCHEMBL11050221 0.74 FFAR4 (0.53) TSHRMEN1KMT2APTPN1FFAR4
SCHEMBL11052302 0.74 FFAR4 (0.53) TSHRMEN1KMT2APTPN1FFAR4
SCHEMBL11032303 0.72 TSHR (0.51) TSHRHPGD
SCHEMBL11967205 0.72 LMNA (0.43) TSHRABCB1MEN1KMT2APTPN1

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-9969703-B2 Triazine-containing photocurable resin and preparation method thereof JIANGNAN UNIVERSITY (CN) 2018-05-15 US disclosed
US-20180044301-A1 TRIAZINE-CONTAINING PHOTOCURABLE RESIN AND PREPARATION METHOD THEREOF JIANGNAN UNIVERSITY (CN) 2018-02-15 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-20180044301-A1 TRIAZINE-CONTAINING PHOTOCURABLE RESIN AND PREPARATION METHOD THEREOF ALOX5, ALKBH5, ALOX15 TSHR 1082/4885ABCB1 3628/4885HPGD 533/4885

“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.