SCHEMBL20508796

SCHEMBL20508796

O=C(c1ccccc1)c1ccc(OP(=O)(O)OP(=O)(O)O)cc1.[KH]

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.49
SRC P12931 1/20 0.47
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
ALDH1A1 P00352 1/20 0.45
STS P08842 1/20 0.45
GAA P10253 1/20 0.45
SRD5A2 P31213 2/20 0.45
POLB P06746 1/20 0.42
PPARA Q07869 1/20 0.42

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
SCHEMBL25184218 0.98 ELANE (0.50) ELANESRCFNTAFNTBALDH1A1
SCHEMBL14672258 0.97 ELANE (0.49) ELANESRCFNTAFNTBALDH1A1
SCHEMBL20508785 0.97 ELANE (0.49) ELANESRCFNTAFNTBALDH1A1
SCHEMBL2553373 0.88 ELANE (0.56) ELANESRCALDH1A1STSGAA
SCHEMBL28324296 0.84 SRC (0.67) ELANESRCALDH1A1STSGAA
SCHEMBL14672257 0.83 SRC (0.64) ELANESRCALDH1A1STSGAA
SCHEMBL1653061 0.82 SRC (0.68) SRCALDH1A1POLB
Methane SCHEMBL11699189 0.81 SRC (0.65) SRCALDH1A1POLB
Benzophenone SCHEMBL31236131 0.80 ALDH1A1 (0.64) ELANESRCFNTAFNTBALDH1A1
SCHEMBL4103871 0.80 SRC (0.50) SRC

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-10253193-B2 Photoactivatable crosslinker SURMODICS, INC. (US) 2019-04-09 US claimed
US-20180273773-A1 PHOTOACTIVATABLE CROSSLINKER BANK OF MONTREAL, AS COLLATERAL AGENT 2018-09-27 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-10253193-B2 Photoactivatable crosslinker GLO1, LCP1, PLOD1 ELANE 3717/4885SRC 1847/4885FNTA 4187/4885
US-20180273773-A1 PHOTOACTIVATABLE CROSSLINKER GLO1, LCP1, PLOD1 ELANE 3717/4885SRC 1847/4885FNTA 4187/4885

“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.