SCHEMBL22320321

SCHEMBL22320321

COCOc1ccc(C)cc1-c1ccccc1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.40
NPC1 O15118 1/20 0.39
LPAR1 Q92633 6/20 0.38
ELANE P08246 1/20 0.37
SYK P43405 1/20 0.36
KDM4E B2RXH2 1/20 0.36
USP1 O94782 1/20 0.36
WDR48 Q8TAF3 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 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
SCHEMBL3684203 0.83 LPAR1 (0.48) LPAR1ELANEKDM4EMEN1CYP3A4
SCHEMBL24133302 0.80 LMNA (0.40) KDM4EL3MBTL1MEN1CYP3A4CYP2C9
SCHEMBL22320291 0.79 L3MBTL1 (0.47) PTGDR2NPC1SYKKDM4EL3MBTL1
SCHEMBL22320330 0.76 L3MBTL1 (0.32) NPC1LPAR1USP1WDR48L3MBTL1
SCHEMBL30423230 0.76 L3MBTL1 (0.32) NPC1LPAR1USP1WDR48L3MBTL1
SCHEMBL1446331 0.74 KMT2A (0.51) L3MBTL1MEN1CYP1A2CYP3A4CYP2C9
SCHEMBL22320292 0.74 PTGDR2 (0.35) PTGDR2NPC1SYKKDM4EL3MBTL1
SCHEMBL28926527 0.72 KMT2A (0.36) NPC1KDM4EL3MBTL1MEN1CYP1A2
SCHEMBL30930957 0.72 L3MBTL1 (0.42) PTGDR2NPC1L3MBTL1MEN1CYP1A2
SCHEMBL14460781 0.71 PTGDR2 (0.40) PTGDR2NPC1SYKKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-11203654-B2 Bis(aryl phenolate) lewis base catalysts and methods thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2021-12-21 US disclosed
WO-2020167824-A1 B!S(ARYL PHENOLATE) LEWIS BASE CATALYSTS AND METHODS THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-08-20 WO 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
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 PTGDR2 1682/4885NPC1 4864/4885LPAR1 742/4885

“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.