SCHEMBL15875002

SCHEMBL15875002

C#CC(O)(c1ccccc1)c1c(C)cccc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ CHRM3 P20309 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ KIF11 P52732 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ PABPC1 P11940 1/20 0.34
▸ APOBEC3A P31941 1/20 0.34
▸ APOBEC3G Q9HC16 1/20 0.34
▸ GABRA1 P14867 1/20 0.33
▸ GABRB2 P47870 1/20 0.33
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ TRPA1 O75762 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ TSHR P16473 2/20 0.32
▸ ACHE P22303 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
SCHEMBL18883812 0.83 GABRA1 (0.38) CHRM3ALDH1A1GABRA1GABRB2TRPA1
SCHEMBL11082289 0.83 ALDH1A1 (0.38) ALDH1A1KIF11KDM4EPABPC1APOBEC3A
SCHEMBL362964 0.80 TSHR (0.43) ALDH1A1KDM4EPABPC1APOBEC3AAPOBEC3G
SCHEMBL15171994 0.78 ESR1 (0.37) ALDH1A1KDM4EPABPC1APOBEC3AAPOBEC3G
SCHEMBL4796677 0.77 MEN1 (0.44) ALDH1A1KIF11ESR1ESR2MEN1
SCHEMBL8129683 0.76 KIF11 (0.41) CHRM2CHRM3ALDH1A1KIF11MEN1
Dimethylamine SCHEMBL8511811 0.76 KCNN4 (0.43) ALDH1A1KDM4EPABPC1APOBEC3AAPOBEC3G
SCHEMBL15886168 0.76 ALDH1A1 (0.36) CHRM2CHRM1CHRM3ALDH1A1KDM4E
SCHEMBL17352348 0.76 ALDH1A1 (0.36) CHRM2CHRM1CHRM3ALDH1A1KDM4E
SCHEMBL17413632 0.76 NOS1 (0.38) ALDH1A1MEN1KMT2ATSHRCYP2D6

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
US-10159966-B2 Catalyst complexes with carbene ligand and method for making same and use in metathesis reaction GUANG MING INNOVATION COMPANY (WUHAN) (CN) 2018-12-25 — — US disclosed
WO-2016000242-A1 GROUP 8 TRANSITION METAL CATALYSTS AND METHOD FOR MAKING SAME AND PROCESS FOR USE OF SAME IN METATHESIS REACTION GUANG MING INNOVATION COMPANY (WUHAN) (CN) 2016-01-07 — — WO disclosed
US-20150367338-A1 CATALYST COMPLEXES WITH CARBENE LIGAND AND METHOD FOR MAKING SAME AND USE IN METATHESIS REACTION GUANG MING INNOVATION COMPANY (WUHAN) (CN) 2015-12-24 — — US disclosed
US-20150367338-A1 CATALYST COMPLEXES WITH CARBENE LIGAND AND METHOD FOR MAKING SAME AND USE IN METATHESIS REACTION GUANG MING INNOVATION COMPANY (WUHAN) (CN) 2015-12-24 — — US disclosed
US-20150367338-A1 CATALYST COMPLEXES WITH CARBENE LIGAND AND METHOD FOR MAKING SAME AND USE IN METATHESIS REACTION GUANG MING INNOVATION COMPANY (WUHAN) (CN) 2015-12-24 — — US disclosed
EP-2943499-A1 CATALYST COMPLEXES WITH CARBENE LIGAND AND METHOD FOR MAKING SAME AND USE IN METATHESIS REACTION Guangming Innovation Company (Wuhan) (CN) 2015-11-18 — — EP disclosed
WO-2014108071-A1 CATALYST COMPLEXES WITH CARBENE LIGAND AND METHOD FOR MAKING SAME AND USE IN METATHESIS REACTION GUANG MING INNOVATION COMPANY (WUHAN) (CN) 2014-07-17 — — WO disclosed
WO-2014108071-A1 CATALYST COMPLEXES WITH CARBENE LIGAND AND METHOD FOR MAKING SAME AND USE IN METATHESIS REACTION GUANG MING INNOVATION COMPANY (WUHAN) (CN) 2014-07-17 — — 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-10159966-B2 Catalyst complexes with carbene ligand and method for making same and use in metathesis reaction MSMO1, ALOX12, SQLE CHRM2 434/4885CHRM1 120/4885CHRM3 611/4885
US-20150367338-A1 CATALYST COMPLEXES WITH CARBENE LIGAND AND METHOD FOR MAKING SAME AND USE IN METATHESIS REACTION MSMO1, ALOX12, SQLE CHRM2 434/4885CHRM1 120/4885CHRM3 611/4885

“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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