SCHEMBL4625148

SCHEMBL4625148

CC1=Cc2c(ccc(C)c2-c2cc(C(C)(C)C)cc(C(C)(C)C)c2)C1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
HTR1D P28221 1/20 0.34
RXRB P28702 5/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
RXRA P19793 4/20 0.32
RXRG P48443 2/20 0.31

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
SCHEMBL2236889 0.85 RXRB (0.33) POLBHTR1DRXRBKDM4EGAA
SCHEMBL4627172 0.81 MEN1 (0.31) MAPT
SCHEMBL2236712 0.78
SCHEMBL27199679 0.77 MEN1 (0.31)
SCHEMBL6908173 0.77 AKT2 (0.33) MAPT
SCHEMBL4626589 0.77 AKT2 (0.33) MAPT
SCHEMBL6031753 0.77 RXRB (0.36) RXRBKDM4EGAAMAPTRXRA
SCHEMBL29594786 0.77 RXRB (0.36) RXRBKDM4EGAAMAPTRXRA
SCHEMBL2235094 0.76 KIF11 (0.37) RXRBRXRA
SCHEMBL2233347 0.76 POLB (0.34) POLBHTR1DRXRBKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456217-B1 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM EXXONMOBIL CHEM PATENTS INC (US) 2008-02-13 EP disclosed
EP-1640377-B1 Metallocenes and catalyst compositions derived therefrom EXXONMOBIL CHEM PATENTS INC (US) 2007-07-25 EP disclosed
US-7157591-B2 Metallocenes and catalyst compositions derived therefrom EXXONMOBIE CHEMICAL PATENTS INC. (US) 2007-01-02 US disclosed
EP-1640377-A1 Metallocenes and catalyst compositions derived therefrom Exxonmobil Chemical Patents Inc. (US) 2006-03-29 EP disclosed
US-20050037919-A1 Metallocenes and catalyst compositions derived therefrom EXXONMOBIL CHEMICAL PATENTS INC. 2005-02-17 US disclosed
EP-1456217-A1 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM Exxonmobil Chemical Patents Inc. (US) 2004-09-15 EP disclosed
WO-2003050131-A1 METALLOCENES AND CATALYST COMPOSITIONS DERIVED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-06-19 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 (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-20050037919-A1 Metallocenes and catalyst compositions derived therefrom HMOX1, RTF1, OPRM1 POLB 908/4885HTR1D 1222/4885RXRB 3628/4885

“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.