SCHEMBL6450591

SCHEMBL6450591

COc1ccc(C2=C(c3ccc(OC)cc3)C(c3ccc(OC)cc3)C(c3ccc(OC)cc3)=C2c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
PTGS2 P35354 3/20 0.46
MAOA P21397 2/20 0.46
NPC1 O15118 2/20 0.46
TP53 P04637 2/20 0.46
MAPT P10636 2/20 0.46
RAB9A P51151 2/20 0.46
HPGD P15428 1/20 0.46
KDM1A O60341 2/20 0.46
MAOB P27338 2/20 0.46
ME2 P23368 1/20 0.44
ME1 P48163 1/20 0.44
ME3 Q16798 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
ESR2 Q92731 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
SCHEMBL3169028 0.74 PTGS2 (0.53) SMN1; SMN2PTGS2MAOANPC1TP53
SCHEMBL20323016 0.74 EDNRA (0.44) SMN1; SMN2PTGS2MAOANPC1TP53
SCHEMBL17971687 0.73 ME2 (0.54) SMN1; SMN2PTGS2MAOANPC1TP53
SCHEMBL6454698 0.72 KDM1A (0.40) PTGS2NPC1RAB9AHPGDKDM1A
SCHEMBL6733562 0.69 CA1 (0.79) SMN1; SMN2NPC1TP53MAPTRAB9A
SCHEMBL9151672 0.69 CA1 (0.79) SMN1; SMN2NPC1TP53MAPTRAB9A
SCHEMBL197522 0.69 CA1 (0.79) SMN1; SMN2NPC1TP53MAPTRAB9A
SCHEMBL6568720 0.68 MEN1 (0.46) SMN1; SMN2MAOANPC1RAB9AHPGD
SCHEMBL28890215 0.67 CA1 (0.73) SMN1; SMN2NPC1TP53MAPTRAB9A
Iodide SCHEMBL28861996 0.67 CA1 (0.73) SMN1; SMN2NPC1TP53MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050171306-A1 Transition metal compound, coordinative compound, catalyst for polymerization of olefin, and process for polymerization of olefin using the catalyst TOSOH CORPORATION (JP) 2005-08-04 US disclosed
US-6919292-B2 Transition metal compound, coordinative compound, catalyst for polymerization of olefin, and process for polymerization of olefin using the catalyst TOSOH CORPORATION (JP) 2005-07-19 US disclosed
US-20020120160-A1 Transition metal compound, coordinative compound, catalyst for polymerization of olefin, and process for polymerization of olefin using the catalyst TOSOH CORPORATION (JP) 2002-08-29 US disclosed
JP-2000053599-A PENTAARYLCYCLOPENTADIENE COMPOUNDS AND PRODUCTION MIURA MASAHIRO 2000-02-22 JP 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-20050171306-A1 Transition metal compound, coordinative compound, catalyst for polymerization of olefin, and process for polymerization of olefin using the catalyst PORCN, FDFT1, CPNE4 SMN1; SMN2 2692/4885PTGS2 984/4885MAOA 267/4885
US-20020120160-A1 Transition metal compound, coordinative compound, catalyst for polymerization of olefin, and process for polymerization of olefin using the catalyst PORCN, FDFT1, CPNE4 SMN1; SMN2 2692/4885PTGS2 984/4885MAOA 267/4885

“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.