SCHEMBL818901

SCHEMBL818901

Cc1ccc(OC2CCCCO2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.44
MAPT P10636 1/20 0.44
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
PDE4B Q07343 2/20 0.40
SYK P43405 1/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
PTPN1 P18031 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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 1.00 RAB9A (0.44) RAB9AMAPTLMNAHPGDPDE4B
SCHEMBL16406595 0.95 MAPT (0.48) RAB9AMAPTLMNAHPGDPDE4B
SCHEMBL22320334 0.86 PDE4B (0.40) RAB9AMAPTPDE4BSYKALDH1A1
SCHEMBL18171755 0.85 PDE4B (0.38) RAB9AMAPTLMNAHPGDPDE4B
SCHEMBL23907105 0.85 PDE4B (0.39) RAB9AMAPTPDE4BNPC1PTPN1
SCHEMBL18362187 0.85 ALDH1A1 (0.45) RAB9AMAPTPDE4BSYKALDH1A1
SCHEMBL723314 0.85 PDE4B (0.39) RAB9AMAPTPDE4BSYKALDH1A1
SCHEMBL7235885 0.85 ACHE (0.49) RAB9APDE4BSYKALDH1A1KDM4E
SCHEMBL7772633 0.85 ACHE (0.49) RAB9APDE4BSYKALDH1A1KDM4E
SCHEMBL7228738 0.85 PDE4B (0.39) RAB9AMAPTPDE4BSYKNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021191724-A1 POLYMERIZATION CATALYST HAVING A TETRADENTATE LIGAND NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2021-09-30 WO disclosed
EP-3227304-B1 FIVE-COORDINATE BIS-PHENYLPHENOXY CATALYSTS FOR THE PREPARATION OF ETHYLENE-BASED POLYMERS DOW GLOBAL TECHNOLOGIES LLC (US) 2020-01-29 EP disclosed
US-20180134817-A1 Catalyst Compositions and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2018-05-17 US disclosed
US-9410016-B2 Aromatic polyacetals and articles comprising them DOW GLOBAL TECHNOLOGIES LLC (US) 2016-08-09 US disclosed
US-9000108-B2 Process for selectively polymerizing ethylene and catalyst therefor DOW GLOBAL TECHNOLOGIES LLC (US) 2015-04-07 US disclosed
US-20150025278-A1 AROMATIC POLYACETALS AND ARTICLES COMPRISING THEM U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2015-01-22 US disclosed
US-20140163186-A1 PROCESS FOR SELECTIVELY POLYMERIZING ETHYLENE AND CATALYST THEREFOR DOW GLOBAL TECHNOLOGIES LLC (US) 2014-06-12 US disclosed
US-20110282018-A1 PROCESS FOR SELECTIVELY POLYMERIZING ETHYLENE AND CATALYST THEREFOR DOW GLOBAL TECHNOLOGIES LLC 2011-11-17 US disclosed
US-6541490-B1 Treating ischemia or reoxygenation injury; preparation from a bipyridine, a benzeneboronic acid and a manganese salt EUKARION, INC. 2003-04-01 US disclosed
EP-1119573-A2 BIPYRIDINE MANGANESE COMPLEXES EUKARION, INC. (US) 2001-08-01 EP disclosed
US-6177419-B1 ANTIOXIDANT CHELATE COMPOUNDS FOR PREVENTING OXYGEN FREE RADICAL-ASSOCIATED DISEASES IN MAMMALS; NEUROPROTECTANTS, SUPEROXIDE DISMUTASE (SOD), CATALASE (CAT) AND/OR PEROXIDASE (POD) MIMETICS EUKARION, INC. 2001-01-23 US disclosed
WO-2000009512-A2 BIPYRIDINE MANGANESE COMPLEXES EUKARION, INC. (US) 2000-02-24 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-20150025278-A1 AROMATIC POLYACETALS AND ARTICLES COMPRISING THEM AR, PARP1, PARG RAB9A 2868/4885MAPT 1051/4885LMNA 1440/4885
US-20110282018-A1 PROCESS FOR SELECTIVELY POLYMERIZING ETHYLENE AND CATALYST THEREFOR WEE2, NOTUM, WEE1 RAB9A 4755/4885MAPT 1699/4885LMNA 1982/4885

“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.