SCHEMBL5897154

SCHEMBL5897154

CC(O)(P(=O)(O)O)P(=O)(O)Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.53
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ANPEP P15144 2/20 0.41
LAP3 P28838 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
FDPS P14324 3/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL4679260 0.80 FDPS (0.44) ALDH1A1LMNATDP1KMT2AFDPS
SCHEMBL7164282 0.80 SRC (0.36) SRCALDH1A1LMNAMEN1KMT2A
SCHEMBL28640641 0.80 SRC (0.52) SRCALDH1A1L3MBTL1TDP1ANPEP
Water SCHEMBL5177023 0.79 FDPS (0.43) ALDH1A1LMNATDP1KMT2AFDPS
SCHEMBL6050586 0.79 SRC (0.54) SRCALDH1A1LMNAL3MBTL1TDP1
SCHEMBL7165035 0.78 ACHE (0.40) SRCALDH1A1LMNAL3MBTL1MEN1
SCHEMBL1491260 0.73 SRC (0.57) SRCALDH1A1L3MBTL1TDP1ANPEP
Tert-Butanol SCHEMBL28023073 0.73 ALDH1A1 (0.55) SRCALDH1A1L3MBTL1TDP1ANPEP
SCHEMBL28203266 0.72 SRC (0.61) SRCALDH1A1L3MBTL1TDP1ANPEP
Phenyl Dihydrogen Phosphate SCHEMBL28023474 0.72 SRC (0.83) SRCALDH1A1L3MBTL1TDP1ANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108912789-A Organic phospho acid doped polyaniline multifunctional coating and preparation method thereof 广西大学 2018-11-30 CN disclosed
US-7005533-B2 Bisphosphonate derivatives, their preparations and uses UNIVERSITE PARIS 13 (FR) 2006-02-28 US disclosed
US-20040266735-A1 Bisphosphonate derivatives, their preparations and uses UNIVERSITE PARIS 13 2004-12-30 US disclosed
US-20030036537-A1 Bisphosphonate derivatives, their preparations and uses UNIVERSITE PARIS, 13 (FR) 2003-02-20 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 (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-20030036537-A1 Bisphosphonate derivatives, their preparations and uses BPGM, PPIP5K2, PTEN SRC 2338/4885ALDH1A1 1252/4885LMNA 2357/4885
US-20040266735-A1 Bisphosphonate derivatives, their preparations and uses BPGM, PPIP5K2, PTEN SRC 2338/4885ALDH1A1 1252/4885LMNA 2357/4885

“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.