SCHEMBL10071781

SCHEMBL10071781

CCCCCCC(C)c1cc(-c2ccc(N)cc2)c2ccccc2c1-c1c(C(C)CCCCCC)cc(-c2ccc(N)cc2)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
CSNK1E P49674 1/20 0.35
LTB4R Q15722 3/20 0.34
ACHE P22303 1/20 0.33
SOAT1 P35610 1/20 0.32
PRKCZ Q05513 1/20 0.32
GCGR P47871 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GRM2 Q14416 1/20 0.31
TLR8 Q9NR97 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
SCHEMBL406374 0.94 CNR1 (0.36) CNR1CNR2CSNK1ELTB4RACHE
SCHEMBL10041933 0.76 TLR8 (0.43) CNR1CNR2KMT2AMEN1KDM4E
SCHEMBL10071168 0.76 CYP17A1 (0.39) CNR2KMT2AKDM4EL3MBTL1
SCHEMBL402987 0.73 TLR8 (0.40) CNR1CNR2ACHEKMT2AMEN1
SCHEMBL20086471 0.71 GRIA4 (0.45) CNR1CNR2CSNK1EKMT2AMEN1
SCHEMBL2878717 0.70 TSHR (0.38) CSNK1EKMT2AMEN1TSHRKDM4E
SCHEMBL7855771 0.70 TSHR (0.38) CSNK1EKMT2AMEN1TSHRKDM4E
SCHEMBL11538867 0.70 TSHR (0.38) CSNK1EKMT2AMEN1TSHRKDM4E
SCHEMBL8683367 0.70 SOAT1 (0.42) CSNK1ESOAT1KMT2AMEN1NPSR1
SCHEMBL6684349 0.70 CSNK1E (0.42) CNR2CSNK1ESOAT1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120013245-A1 ELECTROACTIVE MATERIALS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-01-19 US disclosed
US-8063399-B2 Electroactive materials E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-11-22 US disclosed
US-20110095269-A1 ELECTROACTIVE MATERIALS E. I. DU PONT DE NEMOURS AND COMPANY 2011-04-28 US disclosed
US-20100252819-A1 ELECTROACTIVE MATERIALS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-07 US disclosed
WO-2010114583-A1 ELECTROACTIVE MATERIALS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-07 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 (3 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-20100252819-A1 ELECTROACTIVE MATERIALS HCN2, HCN4, HCN3 CNR1 715/4885CNR2 576/4885CSNK1E 3643/4885
US-20120013245-A1 ELECTROACTIVE MATERIALS NAT1, ADRA1D, ADRA1B CNR1 228/4885CNR2 338/4885CSNK1E 1684/4885
US-20110095269-A1 ELECTROACTIVE MATERIALS NAT1, ADRA1D, ADRA1B CNR1 228/4885CNR2 338/4885CSNK1E 1684/4885

“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.