SCHEMBL15534136

SCHEMBL15534136

C=Cc1ccc(C(P(=O)(O)O)P(=O)(O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.54
ALDH1A1 P00352 2/20 0.46
TDP1 Q9NUW8 1/20 0.41
PGK1 P00558 6/20 0.40
PGK2 P07205 6/20 0.40
TAS1R3 Q7RTX0 2/20 0.37
TAS1R1 Q7RTX1 2/20 0.37
TSHR P16473 2/20 0.36
ACP3 P15309 2/20 0.34
ALOX15 P16050 1/20 0.32
HSD17B2 P37059 1/20 0.32
PTGS2 P35354 1/20 0.32

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
SCHEMBL9301497 0.82 SRC (0.75) SRCPGK1PGK2ACP3
SCHEMBL4881249 0.80 ALDH1A1 (0.42) ALDH1A1TDP1PGK1PGK2TAS1R3
SCHEMBL5058077 0.77 ACP3 (0.40) ALDH1A1TDP1PGK1PGK2TAS1R3
SCHEMBL2171583 0.75 SRC (0.65) SRCPGK1PGK2ACP3
SCHEMBL5936840 0.73 SRC (0.62) SRCALDH1A1TDP1PGK1PGK2
SCHEMBL19273327 0.72 ALDH1A1 (0.61) ALDH1A1TDP1TAS1R3TAS1R1TSHR
SCHEMBL30083976 0.72 ALDH1A1 (0.61) ALDH1A1TDP1TAS1R3TAS1R1TSHR
SCHEMBL744205 0.71 SRC (0.60) SRCALDH1A1PGK1PGK2ACP3
SCHEMBL4093802 0.71 SRC (0.60) SRCTDP1PGK1PGK2TSHR
SCHEMBL1552133 0.71 SRC (0.60) SRCPGK1PGK2TSHRACP3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2852600-B1 BISPHOSPHONATES VINYLIC MONOMERS AND POLYMERS AND USES THEREOF UNIV BAR ILAN (IL) 2021-10-13 EP disclosed
US-20180155374-A1 BISPHOSPHONATES VINYLIC MONOMERS AND POLYMERS AND USES THEREOF BAR-ILAN UNIVERSITY 2018-06-07 US disclosed
US-9690192-B2 Composition for base, and directed self-assembly lithography method JSR CORPORATION (JP) 2017-06-27 US disclosed
EP-2852600-A1 BISPHOSPHONATES VINYLIC MONOMERS AND POLYMERS AND USES THEREOF Bar Ilan Research&Development Company Ltd. (IL) 2015-04-01 EP disclosed
WO-2013175385-A1 BISPHOSPHONATES VINYLIC MONOMERS AND POLYMERS AND USES THEREOF BAR-ILAN RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 2013-11-28 WO 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-20180155374-A1 BISPHOSPHONATES VINYLIC MONOMERS AND POLYMERS AND USES THEREOF PTH1R, PITHD1, VCL SRC 539/4885ALDH1A1 4450/4885TDP1 4567/4885

“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.