SCHEMBL3917751

SCHEMBL3917751

O=P(O)(O)Oc1c(-c2ccc3c(c2O)CCCC3)ccc2c1CCCC2

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 2/20 0.36
INPP5A Q14642 2/20 0.36
AKT1 P31749 1/20 0.36
CTRC Q99895 1/20 0.34
BCL2L1 Q07817 1/20 0.34
BAD Q92934 1/20 0.34
INPP5B P32019 1/20 0.34
SRC P12931 2/20 0.34
STS P08842 1/20 0.34
CXCR2 P25025 4/20 0.33
FBP1 P09467 1/20 0.33
CES1 P23141 2/20 0.33
NQO1 P15559 1/20 0.33
PARP1 P09874 1/20 0.33
PRKAB2 O43741 1/20 0.32
GRIA1 P42261 1/20 0.31
GRIA2 P42262 1/20 0.31
GRIA3 P42263 1/20 0.31
GRIA4 P48058 1/20 0.31

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
SCHEMBL1046490 0.79 BCL2L1 (0.50) CTRCBCL2L1BADCES1NQO1
SCHEMBL6557595 0.70 INPPL1 (0.46) INPPL1INPP5AAKT1BCL2L1BAD
SCHEMBL1046489 0.65 MEN1 (0.41) CTRCBCL2L1BADCES1NQO1
SCHEMBL3797823 0.64 BCL2L1 (0.56) CTRCBCL2L1BADNQO1GRIA1
SCHEMBL1660189 0.62 BCL2L1 (0.48) CTRCBCL2L1BADCES1NQO1
SCHEMBL2787728 0.62 SELL (0.47) CTRCBCL2L1BADNQO1
Phosphoric Acid SCHEMBL3922743 0.62 BCL2L1 (0.53) BCL2L1BAD
SCHEMBL21051968 0.61 BCL2L1 (0.47) CTRCBCL2L1BADCES1NQO1
SCHEMBL14354818 0.61 BCL2L1 (0.47) CTRCBCL2L1BADCES1NQO1
SCHEMBL5768853 0.61 BCL2L1 (0.47) CTRCBCL2L1BADCXCR2CES1

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-7517828-B2 Chiral broensted acid catalyst for asymmetric synthesis and method of asymmetric synthesis with the catalyst TOAGOSEI CO., LTD. (JP) 2009-04-14 US claimed
US-20060276329-A1 Asymmetric synthesis catalyst based on chiral brsnsted acid and method of asymmetric synthesis with the catalyst TOAGOSEI CO., LTD. (JP) 2006-12-07 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 (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-20060276329-A1 Asymmetric synthesis catalyst based on chiral brsnsted acid and method of asymmetric synthesis with the catalyst LSS, COASY, FASN INPPL1 4276/4885INPP5A 3075/4885AKT1 708/4885

“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.