SCHEMBL26923110

SCHEMBL26923110

CC(C)c1ccc(C2CCC(O)CC2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 3/20 0.44
▸ MGLL Q99685 1/20 0.39
▸ APP P05067 1/20 0.36
▸ IDH1 O75874 1/20 0.35
▸ HSD11B1 P28845 2/20 0.35
▸ SOS1 Q07889 2/20 0.35
▸ QDPR P09417 1/20 0.35
▸ PTGS1 P23219 5/20 0.33
▸ PTGS2 P35354 5/20 0.33
▸ PDK2 Q15119 1/20 0.33
▸ PDE2A O00408 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.32
▸ TLR8 Q9NR97 1/20 0.32
▸ TLR7 Q9NYK1 1/20 0.32
▸ HIF1A Q16665 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
SCHEMBL29611795 1.00 ESR2 (0.44) ESR2MGLLAPPIDH1HSD11B1
SCHEMBL15028921 0.92 MGLL (0.40) ESR2MGLLAPPIDH1PTGS1
SCHEMBL13499049 0.85 APP (0.41) MGLLAPPIDH1PTGS1PTGS2
SCHEMBL21872033 0.83 APP (0.43) MGLLAPPPTGS1PTGS2PDK2
SCHEMBL21872202 0.83 APP (0.43) MGLLAPPPTGS1PTGS2PDK2
SCHEMBL21872092 0.83 APP (0.43) MGLLAPPPTGS1PTGS2PDK2
SCHEMBL30910925 0.81 PDE2A (0.38) ESR2MGLLAPPIDH1QDPR
SCHEMBL18097789 0.81 PDE2A (0.38) ESR2MGLLAPPIDH1QDPR
SCHEMBL14817246 0.79 ESR2 (0.53) ESR2QDPRPDK2
SCHEMBL21831890 0.78 IDH1 (0.37) ESR2MGLLAPPIDH1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114426465-B Method for carrying out photo-delay reaction on alcohol hydroxyl donor and active hydrogen donor 江苏和成新材料有限公司 2024-02-06 — — CN disclosed
US-20230399281-A1 METHOD FOR PERFORMING MITSUNOBU REACTION BETWEEN ALCOHOLIC HYDROXYL GROUP DONOR AND ACTIVE HYDROGEN DONOR JIANGSU HECHENG ADVANCED MATERIALS CO., LTD. (CN) 2023-12-14 — — US disclosed
US-20230399281-A1 METHOD FOR PERFORMING MITSUNOBU REACTION BETWEEN ALCOHOLIC HYDROXYL GROUP DONOR AND ACTIVE HYDROGEN DONOR JIANGSU HECHENG ADVANCED MATERIALS CO., LTD. (CN) 2023-12-14 — — US disclosed
US-20230399281-A1 METHOD FOR PERFORMING MITSUNOBU REACTION BETWEEN ALCOHOLIC HYDROXYL GROUP DONOR AND ACTIVE HYDROGEN DONOR JIANGSU HECHENG ADVANCED MATERIALS CO., LTD. (CN) 2023-12-14 — — US disclosed
CN-114426466-B Method for carrying out photo-delay reaction on alcohol hydroxyl donor and active hydrogen donor 江苏和成新材料有限公司 2023-11-21 — — CN disclosed
WO-2022088244-A1 METHOD FOR PERFORMING MITSUNOBU REACTION BETWEEN ALCOHOLIC HYDROXYL GROUP DONOR AND ACTIVE HYDROGEN DONOR 江苏和成新材料有限公司 2022-05-05 — — WO disclosed
CN-114426466-A Method for carrying out mitsunobu reaction on alcoholic hydroxyl donor and active hydrogen donor 江苏和成新材料有限公司 2022-05-03 — — CN disclosed
CN-114426465-A Method for carrying out mitsunobu reaction on alcoholic hydroxyl donor and active hydrogen donor 江苏和成新材料有限公司 2022-05-03 — — CN 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-20230399281-A1 METHOD FOR PERFORMING MITSUNOBU REACTION BETWEEN ALCOHOLIC HYDROXYL GROUP DONOR AND ACTIVE HYDROGEN DONOR ADH5, ADH1C, ADH1A ESR2 3431/4885MGLL 302/4885APP 4133/4885

“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.

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