SCHEMBL3858281

SCHEMBL3858281

CCCOc1cc(C(=O)O)cc(C(=O)OC)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.59
▸ KMT2A Q03164 1/20 0.58
▸ NR1H4 Q96RI1 3/20 0.49
▸ MAPT P10636 2/20 0.49
▸ RAB9A P51151 1/20 0.47
▸ TP53 P04637 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ PLK1 P53350 1/20 0.44
▸ KDM4E B2RXH2 3/20 0.43
▸ PLA2G4B P0C869 2/20 0.43
▸ KDM6B O15054 1/20 0.43
▸ KDM5C P41229 1/20 0.43
▸ KDM4C Q9H3R0 1/20 0.43
▸ KDM2A Q9Y2K7 1/20 0.43
▸ KDM3A Q9Y4C1 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ FABP1 P07148 1/20 0.42
▸ LMNA P02545 1/20 0.42

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
SCHEMBL19999965 0.93 MAPT (0.55) PLA2G2AKMT2ANR1H4MAPTRAB9A
SCHEMBL2772131 0.92 PLA2G2A (0.67) PLA2G2AKMT2ANR1H4MAPTRAB9A
SCHEMBL25659599 0.90 MAPT (0.55) PLA2G2AKMT2ANR1H4MAPTRAB9A
SCHEMBL17109507 0.90 PLA2G2A (0.71) PLA2G2AKMT2ANR1H4TP53TSHR
SCHEMBL9402625 0.89 PLA2G2A (0.77) PLA2G2ANR1H4TP53TSHRPLA2G4B
SCHEMBL39386 0.87 MAPT (0.53) PLA2G2AKMT2AMAPTRAB9AKDM4E
SCHEMBL5155253 0.87 PLA2G2A (0.47) PLA2G2AKMT2ANR1H4MAPTRAB9A
SCHEMBL5218694 0.87 PLA2G2A (0.50) PLA2G2AKMT2ANR1H4RAB9ATP53
SCHEMBL23352165 0.86 PLA2G2A (0.77) PLA2G2AKMT2ANR1H4TP53TSHR
SCHEMBL89430 0.86 PLA2G2A (0.54) PLA2G2AKMT2ANR1H4MAPTRAB9A

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-20180090787-A1 SOLID ELECTROLYTE COMPOSITION, ELECTRODE SHEET FOR ALL-SOLID STATE SECONDARY BATTERY, ALL-SOLID STATE SECONDARY BATTERY, AND METHODS FOR MANUFACTURING ELECTRODE SHEET FOR ALL-SOLID STATE SECONDARY BATTERY AND ALL-SOLID STATE SECONDARY BATTERY FUJIFILM CORPORATION (JP) 2018-03-29 — — US disclosed
US-7618978-B2 Amides as BACE inhibitors ELI LILLY AND COMPANY (US) 2009-11-17 — — US disclosed
US-7585885-B2 Pyrrolidine derivatives useful as BACE inhibitors ELI LILLY AND COMPANY (US) 2009-09-08 — — US disclosed
US-20070225372-A1 Amides as Bace Inhibitors ELI LILLY AND COMPANY 2007-09-27 — — US disclosed
US-20070213331-A1 PYRROLIDINE DERIVATIVES USEFUL AS BASE INHIBITORS ELI LILLY AND COMPANY 2007-09-13 — — US disclosed
EP-1740573-A1 AMIDES AS BACE INHIBITORS ELI LILLY AND COMPANY (US) 2007-01-10 — — EP disclosed
EP-1740575-A2 PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS ELI LILLY AND COMPANY (US) 2007-01-10 — — EP disclosed
WO-2005108358-A2 PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS ELI LILLY AND COMPANY (US) 2005-11-17 — — WO disclosed
WO-2005108391-A1 AMIDES AS BACE INHIBITORS ELI LILLY AND COMPANY (US) 2005-11-17 — — 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 (2 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-20070225372-A1 Amides as Bace Inhibitors BACE2, BACE1, APP PLA2G2A 3061/4885KMT2A 619/4885NR1H4 1354/4885
US-20070213331-A1 PYRROLIDINE DERIVATIVES USEFUL AS BASE INHIBITORS BACE1, BACE2, PSEN1 PLA2G2A 3456/4885KMT2A 2934/4885NR1H4 3310/4885

“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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