SCHEMBL30007239

SCHEMBL30007239

O=P(O)(O)CCCOc1ccc2[nH]c3c(c2c1)CCCC3

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.50
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 4/20 0.50
LMNA P02545 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TP53 P04637 3/20 0.46
CASP1 P29466 1/20 0.46
HTR1D P28221 2/20 0.46
HTR1B P28222 2/20 0.46
PARP1 P09874 2/20 0.46
EGFR P00533 1/20 0.45
IGF1R P08069 1/20 0.45
FLT4 P35916 1/20 0.45
KDR P35968 1/20 0.45
F2 P00734 1/20 0.44
GFER P55789 1/20 0.44

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
SCHEMBL3264595 0.82 KMT2A (0.57) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL7984120 0.79 PARP1 (0.57) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL60525 0.77 KMT2A (0.69) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL6246029 0.73 MAPT (0.54) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL8316089 0.73 MAPKAPK2 (0.55) MAPTLMNAKMT2AMEN1TP53
SCHEMBL4286367 0.72 LMNA (0.67) MAPTALDH1A1KDM4ELMNAKMT2A
Calcium SCHEMBL29917796 0.71 LMNA (0.65) MAPTALDH1A1KDM4ELMNAKMT2A
SCHEMBL8316102 0.70 MAPKAPK2 (0.55) MAPTLMNATP53
SCHEMBL7980939 0.70 MAPT (0.54) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL7980845 0.69 PARP1 (0.49) MAPTALDH1A1KDM4ELMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220370411-A1 EARLY MANAGEMENT, MITIGATION and PREVENTION OF SEPSIS and SEPSIS-LIKE SYNDROMES, INCLUDING NEO-NATAL ARDS DUE TO INFECTION, INJURY or IATROGENESIS OPHIREX INC (US) 2022-11-24 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-20220370411-A1 EARLY MANAGEMENT, MITIGATION and PREVENTION OF SEPSIS and SEPSIS-LIKE SYNDROMES, INCLUDING NEO-NATAL ARDS DUE TO INFECTION, INJURY or IATROGENESIS PLA2G12A, PLA2G3, PLA2G1B MAPT 4608/4885ALDH1A1 2661/4885KDM4E 1513/4885

“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.