SCHEMBL6542610

SCHEMBL6542610

COc1ccc(Cc2ccccc2P)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.62
MAOB P27338 1/20 0.48
TAAR1 Q96RJ0 1/20 0.47
CYP11B1 P15538 3/20 0.46
CYP11B2 P19099 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
IDO1 P14902 1/20 0.45
MEN1 O00255 1/20 0.45
NSD2 O96028 1/20 0.45
KMT2A Q03164 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
ABCB1 P08183 1/20 0.44
SLC5A1 P13866 1/20 0.44
SLC5A2 P31639 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
SCHEMBL28251912 0.88 LTA4H (0.72) LTA4HMAOBCYP11B1CYP11B2L3MBTL1
SCHEMBL28131751 0.86 LTA4H (0.64) LTA4HMAOBCYP11B1CYP11B2L3MBTL1
SCHEMBL381565 0.86 LTA4H (0.50) LTA4HMAOBCYP11B1CYP11B2SMN1; SMN2
SCHEMBL2027109 0.86 LTA4H (0.69) LTA4HMAOBCYP11B1CYP11B2L3MBTL1
SCHEMBL5158250 0.83 LTA4H (0.60) LTA4HMAOBCYP11B1CYP11B2L3MBTL1
SCHEMBL26949212 0.82 LTA4H (0.64) LTA4HMAOBCYP11B1CYP11B2L3MBTL1
SCHEMBL11289347 0.81 LTA4H (0.62) LTA4HMAOBCYP11B1CYP11B2L3MBTL1
SCHEMBL7282070 0.81 LTA4H (0.62) LTA4HMAOBTAAR1L3MBTL1TDP1
SCHEMBL21227008 0.80 LTA4H (0.56) LTA4HMAOBTAAR1CYP11B1CYP11B2
SCHEMBL254705 0.79 KEAP1 (0.63) LTA4HMAOBCYP11B1CYP11B2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040133042-A1 Diphosphines BROWN JOHN MICHAEL (GB) 2004-07-08 US claimed
EP-1124833-B1 DIPHOSPHINES ISIS INNOVATION (GB) 2003-01-08 EP claimed
EP-1124833-A1 DIPHOSPHINES ISIS INNOVATION LIMITED (GB) 2001-08-22 EP claimed
WO-2000026220-A1 DIPHOSPHINES ISIS INNOVATION LIMITED (GB) 2000-05-11 WO claimed
US-20040133042-A1 Diphosphines BROWN JOHN MICHAEL (GB) 2004-07-08 US disclosed
US-6706926-B1 ENANTIOSELECTIVE HYDROGENATION CATALYSTS ISIS INNOVATION LIMITED (GB) 2004-03-16 US disclosed
EP-1124833-B1 DIPHOSPHINES ISIS INNOVATION (GB) 2003-01-08 EP disclosed
EP-1124833-A1 DIPHOSPHINES ISIS INNOVATION LIMITED (GB) 2001-08-22 EP disclosed
WO-2000026220-A1 DIPHOSPHINES ISIS INNOVATION LIMITED (GB) 2000-05-11 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-20040133042-A1 Diphosphines SIGMAR1, SSR4, LBR LTA4H 2699/4885MAOB 4527/4885TAAR1 2759/4885

“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.