SCHEMBL5873300

SCHEMBL5873300

CC(C)(C)c1ccc(-c2[c]c(Cl)cc(-c3ccc(C(C)(C)C)cc3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 1/20 0.42
KIF11 P52732 4/20 0.41
RXRA P19793 3/20 0.35
RXRB P28702 3/20 0.35
RXRG P48443 2/20 0.35
CNR1 P21554 2/20 0.35
TSHR P16473 1/20 0.34
XDH P47989 1/20 0.34
DHODH Q02127 1/20 0.33
MITF O75030 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
TYR P14679 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
CA12 O43570 1/20 0.32
CA9 Q16790 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
SCHEMBL5873304 0.80 KIF11 (0.44) AKR1C2AKR1C1KIF11RXRARXRB
SCHEMBL5873293 0.76 KIF11 (0.39) AKR1C2AKR1C1KIF11RXRARXRB
SCHEMBL23319641 0.73 KIF11 (0.61) AKR1C2AKR1C1KIF11RXRARXRB
SCHEMBL4322427 0.73 KIF11 (0.61) AKR1C2AKR1C1KIF11RXRARXRB
SCHEMBL14666772 0.72 CNR1 (0.51) AKR1C2AKR1C1KIF11RXRARXRB
SCHEMBL16908378 0.71 MMP3 (0.42) KIF11TSHRALDH1A1CA12CA9
SCHEMBL5134086 0.71 KIF11 (0.48) AKR1C2AKR1C1KIF11RXRARXRB
SCHEMBL31156291 0.71 AHR (0.58) AKR1C2AKR1C1KIF11RXRARXRB
SCHEMBL3423876 0.71 KIF11 (0.70) KIF11TSHRXDHMITFALDH1A1
SCHEMBL26915 0.71 KIF11 (0.70) KIF11TSHRXDHMITFALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7056996-B2 Productivity catalysts and microstructure control E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-06-06 US disclosed
US-20040127658-A1 Productivity catalysts and microstructure control EASTMAN CHEMICAL COMPANY 2004-07-01 US disclosed
US-20040077809-A1 Productivity catalysts and microstructure control EASTMAN CHEMICAL COMPANY 2004-04-22 US disclosed
EP-1404723-A2 OLEFIN POLYMERIZATION PROCESSES USING SUPPORTED CATALYSTS EASTMAN CHEMICAL COMPANY (US) 2004-04-07 EP disclosed
EP-1351997-A2 IMPROVED PRODUCTIVITY CATALYSTS AND MICROSTRUCTURE CONTROL EASTMAN CHEMICAL COMPANY (US) 2003-10-15 EP disclosed
US-6605677-B2 Group 8-10 transition metal based supported catalyst where the support is treated with a pore-filling agent; improved the catalyst productivity in the presence of hydrogen EASTMAN CHEMICAL COMPANY 2003-08-12 US disclosed
US-20020091210-A1 Olefin polymerization processes using supported catalysts E. I. DU PONT DE NEMOURS AND COMPANY 2002-07-11 US disclosed
US-20020065192-A1 Productivity catalysts and microstructure control MACKENZIE PETER BORDEN (US) 2002-05-30 US disclosed
WO-2002036641-A2 IMPROVED PRODUCTIVITY CATALYSTS AND MICROSTRUCTURE CONTROL EASTMAN CHEMICAL COMPANY (US) 2002-05-10 WO disclosed
WO-2002036642-A2 OLEFIN POLYMERIZATION PROCESSES USING SUPPORTED CATALYSTS EASTMAN CHEMICAL COMPANY (US) 2002-05-10 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 (1 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-20040077809-A1 Productivity catalysts and microstructure control MYB, ST3GAL3, FASN AKR1C2 3593/4885AKR1C1 3837/4885KIF11 357/4885

“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.