SCHEMBL22320334

SCHEMBL22320334

[Li]c1cc(C)ccc1OC1CCCCO1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.40
SYK P43405 1/20 0.40
PTPN1 P18031 4/20 0.37
RAB9A P51151 3/20 0.36
MAPT P10636 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NPC1 O15118 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
DHFR P00374 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
TP53 P04637 1/20 0.33
CASP1 P29466 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
HSD11B1 P28845 1/20 0.32

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
SCHEMBL7772772 0.86 RAB9A (0.44) PDE4BSYKPTPN1RAB9AMAPT
SCHEMBL818901 0.86 RAB9A (0.44) PDE4BSYKPTPN1RAB9AMAPT
SCHEMBL7772633 0.84 ACHE (0.49) PDE4BSYKPTPN1RAB9AALDH1A1
SCHEMBL28630514 0.84 PDE4B (0.39) PDE4BSYKPTPN1RAB9AMAPT
SCHEMBL1423552 0.84 PTPN1 (0.39) PDE4BSYKPTPN1RAB9AMAPT
SCHEMBL723314 0.84 PDE4B (0.39) PDE4BSYKPTPN1RAB9AMAPT
SCHEMBL18362187 0.84 ALDH1A1 (0.45) PDE4BSYKPTPN1RAB9AMAPT
SCHEMBL7235885 0.84 ACHE (0.49) PDE4BSYKPTPN1RAB9AALDH1A1
SCHEMBL16397520 0.82 SYK (0.47) PDE4BSYKPTPN1RAB9AMAPT
SCHEMBL16406595 0.81 MAPT (0.48) PDE4BSYKRAB9AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113423742-B Bis (arylphenoxide) lewis base catalysts and methods thereof 埃克森美孚化学专利公司 2023-05-05 CN disclosed
EP-3924395-A1 B!S(ARYL PHENOLATE) LEWIS BASE CATALYSTS AND METHODS THEREOF ExxonMobil Chemical Patents Inc. (US) 2021-12-22 EP disclosed
US-11203654-B2 Bis(aryl phenolate) lewis base catalysts and methods thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2021-12-21 US disclosed
CN-113423742-A Bis (arylphenolate) lewis base catalysts and processes thereof 埃克森美孚化学专利公司 2021-09-21 CN disclosed
WO-2020167824-A1 B!S(ARYL PHENOLATE) LEWIS BASE CATALYSTS AND METHODS THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-08-20 WO disclosed
US-20200254431-A1 BIS(ARYL PHENOLATE) LEWIS BASE CATALYSTS AND METHODS THEREOF EXXONMOBIL CHEMICAL PATENTS INC. 2020-08-13 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-11203654-B2 Bis(aryl phenolate) lewis base catalysts and methods thereof PHKB, TYR, ELL PDE4B 3612/4885SYK 361/4885PTPN1 202/4885

“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.