SCHEMBL22005177

SCHEMBL22005177

CCCCc1cc(CCCC)cc(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 10/20 0.65
LPL P06858 9/20 0.65
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
F11 P03951 1/20 0.37
PTGS2 P35354 3/20 0.36
CYP3A4 P08684 1/20 0.36
GPR84 Q9NQS5 2/20 0.36
SKP2 Q13309 1/20 0.36
ESR2 Q92731 1/20 0.35

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
SCHEMBL10071636 0.96 LIPG (0.65) LIPGLPLNPC1HPGDMAPK1
SCHEMBL16601879 0.93 LPL (0.71) LIPGLPLPTGS2CYP3A4GPR84
SCHEMBL15132542 0.93 LPL (0.71) LIPGLPLPTGS2CYP3A4GPR84
SCHEMBL29400355 0.90 LPL (0.71) LIPGLPLPTGS2CYP3A4GPR84
SCHEMBL12620510 0.84 LPL (0.64) LIPGLPLPTGS2CYP3A4GPR84
SCHEMBL14750160 0.83 LIPG (0.91) LIPGLPLF11SKP2
SCHEMBL31442702 0.83 LPL (0.62) LIPGLPLPTGS2CYP3A4
SCHEMBL13471474 0.82 LIPG (0.90) LIPGLPLF11ESR2
SCHEMBL18230458 0.81 LIPG (0.52) LIPGLPLF11ESR2
SCHEMBL31442550 0.80 LPL (0.58) LIPGLPL

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
US-11800785-B2 Material for organic device and organic electroluminescent device using the same KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-10-24 US disclosed
US-20220006012-A1 MATERIAL FOR ORGANIC DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2022-01-06 US disclosed
US-11168161-B2 Biaryl phenoxy group IV transition metal catalysts for olefin polymerization DOW GLOBAL TECHNOLOGIES LLC (US) 2021-11-09 US disclosed
US-20200157254-A1 BIARYL PHENOXY GROUP IV TRANSITION METAL CATALYSTS FOR OLEFIN POLYERMIZATION DOW GLOBAL TECHNOLOGIES LLC (US) 2020-05-21 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 (3 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-11800785-B2 Material for organic device and organic electroluminescent device using the same RER1, LEF1, CHRM1 LIPG 3005/4885LPL 2241/4885NPC1 2280/4885
US-11168161-B2 Biaryl phenoxy group IV transition metal catalysts for olefin polymerization PPOX, LIG4, PARG LIPG 2258/4885LPL 2686/4885NPC1 4629/4885
US-20220006012-A1 MATERIAL FOR ORGANIC DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME RER1, LEF1, CHRM1 LIPG 3005/4885LPL 2241/4885NPC1 2280/4885

“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.