SCHEMBL6092486

SCHEMBL6092486

C1=C(N2CCCC2)c2ccccc2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 1/20 0.43
TDP2 O95551 1/20 0.43
NSD2 O96028 1/20 0.43
HKDC1 Q2TB90 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MAPT P10636 3/20 0.42
MAPK1 P28482 3/20 0.40
EGFR P00533 1/20 0.40
RAF1 P04049 1/20 0.40
ALOX12 P18054 1/20 0.40
MAP2K1 Q02750 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KEAP1 Q14145 1/20 0.38
PTGS2 P35354 2/20 0.36
KDM4E B2RXH2 1/20 0.35
TSHR P16473 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
GFER P55789 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL30832650 1.00 APAF1 (0.43) APAF1TDP2NSD2HKDC1ALDH1A1
SCHEMBL6904573 0.98 APAF1 (0.46) APAF1TDP2NSD2HKDC1ALDH1A1
SCHEMBL8244044 0.85 DRD2 (0.48) TDP2NSD2MAPTMAPK1EGFR
SCHEMBL8796353 0.83 MEN1 (0.49) APAF1TDP2NSD2HKDC1ALDH1A1
SCHEMBL687468 0.82 ALDH1A1 (0.44) ALDH1A1MAPTMAPK1L3MBTL1KDM4E
SCHEMBL669617 0.81 APAF1 (0.41) APAF1TDP2NSD2HKDC1ALDH1A1
SCHEMBL686641 0.80 ALDH1A1 (0.42) ALDH1A1MAPTMAPK1EGFRL3MBTL1
Lithium SCHEMBL686643 0.80 ALDH1A1 (0.42) ALDH1A1MAPTMAPK1EGFRL3MBTL1
SCHEMBL11620336 0.79 APAF1 (0.44) APAF1TDP2NSD2HKDC1ALDH1A1
SCHEMBL28018501 0.79 APAF1 (0.38) APAF1TDP2NSD2HKDC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240392044-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM AND POLYMERIZATION PROCESS NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2024-11-28 US disclosed
EP-4405367-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM AND POLYMERIZATION PROCESS Nova Chemicals (International) S.A. (CH) 2024-07-31 EP disclosed
CN-117980314-A Olefin polymerization catalyst system and polymerization process 诺瓦化学品(国际)股份有限公司 2024-05-03 CN disclosed
WO-2023042155-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM AND POLYMERIZATION PROCESS NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2023-03-23 WO disclosed
US-7060710-B2 Isoxazole pyrazoloindane derivatives as cognition enhancing GABAA α5 subtype ligands MERCK SHARP & DOHME LTD. (GB) 2006-06-13 US disclosed
EP-1501843-A1 ALKARYL-SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2005-02-02 EP disclosed
US-6825295-B2 COORDINATION POLYMERIZATION CATALYST DOW GLOBAL TECHNOLOGIES INC. 2004-11-30 US disclosed
EP-0923589-B1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2004-09-15 EP disclosed
WO-2004044018-A2 PROCESS FOR HOMO- OR COPOLYMERIZATION OF CONJUGATED DIENES AND IN SITU FORMATION OF POLYMER BLENDS AND PRODUCTS MADE THEREBY DOW GLOBAL TECHNOLOGIES, INC. (US) 2004-05-27 WO disclosed
US-20040006226-A1 Isoxazole pyrazoloindane derivatives as cognition enhancing GABA-A alpha 5 subtype ligands MERCK SHARP & DOHME LTD. (GB) 2004-01-08 US disclosed
WO-2003091265-A1 ALKARYL-SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2003-11-06 WO disclosed
US-6515155-B1 Group 4 metal complexes of the constrained geometry type, catalysts derived therefrom and polymerization processes using the same, characterized by a nitrogen containing aliphatic or cycloaliphatic moiety that is substituted with one or more DOW GLOBAL TECHNOLOGIES INC. 2003-02-04 US disclosed
US-20030004286-A1 Alkaryl-substituted Group 4 metal complexes, catalysts and olefin polymerization process DOW GLOBAL TECHNOLOGIES LLC 2003-01-02 US disclosed
US-20020165329-A1 Heat-resistant group 4 metal metallecenes having a nitrogen with aliphatic or cycloaliphatic moiety substituted with aryl group(s)and a silane bridge; high-molecular weight ethylene-alpha olefin copolymers; high concentration of comonomer KLOSIN JERZY (US) 2002-11-07 US disclosed
EP-1253158-A1 Substituted group 4 metal complexes, catalysts and olefin polymerization process DOW GLOBAL TECHNOLOGIES INC. (US) 2002-10-30 EP disclosed
EP-1242471-A1 SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 2002-09-25 EP disclosed
US-6268444-B1 TITANIUM, ZIRCONIUM OR HAFNIUM COMPOUNDS FOR POLYMERIZATION DOW CHEMICAL COMPANY 2001-07-31 US disclosed
WO-2001042315-A1 SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2001-06-14 WO disclosed
EP-0923589-A1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1999-06-23 EP disclosed
WO-1998006727-A1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1998-02-19 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-20040006226-A1 Isoxazole pyrazoloindane derivatives as cognition enhancing GABA-A alpha 5 subtype ligands GABRA5, GABRB1, GABRA4 APAF1 4111/4885TDP2 2684/4885NSD2 2618/4885
US-20020165329-A1 Heat-resistant group 4 metal metallecenes having a nitrogen with aliphatic or cycloaliphatic moiety substituted with aryl group(s)and a silane bridge; high-molecular weight ethylene-alpha olefin copolymers; high concentration of comonomer B2M, WEE2, WASF2 APAF1 3532/4885TDP2 4739/4885NSD2 4351/4885

“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.