SCHEMBL2053076

SCHEMBL2053076

Cc1cnc2c(=O)[c]cn(C)c2c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.36
CCR5 P51681 2/20 0.36
CCR8 P51685 2/20 0.36
PDE10A Q9Y233 1/20 0.33
KDM4E B2RXH2 1/20 0.30
PSMD14 O00487 1/20 0.30
COPS5 Q92905 1/20 0.30

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
SCHEMBL15031276 0.69 CCR1 (0.42) CCR1CCR5CCR8PDE10AKDM4E
SCHEMBL2113298 0.66 LMNA (0.37) PDE10AKDM4E
SCHEMBL20117306 0.63 ADORA2A (0.47) CCR1CCR5CCR8PDE10AKDM4E
SCHEMBL25515239 0.62 L3MBTL1 (0.39) CCR1CCR5CCR8KDM4E
SCHEMBL19657540 0.62 HSD17B10 (0.65) PDE10A
SCHEMBL27262438 0.61 CCR1 (0.55) CCR1CCR5CCR8KDM4EPSMD14
SCHEMBL22306200 0.61 F2RL3 (0.39) CCR1CCR5CCR8
SCHEMBL17813501 0.61 KDM4E (0.34) CCR1CCR5CCR8KDM4E
SCHEMBL17813472 0.60 CYP1A2 (0.36) CCR1CCR5CCR8PDE10AKDM4E
SCHEMBL30968108 0.60 CCR1 (0.39) CCR1CCR5CCR8KDM4EPSMD14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2388003-B1 Colchicine derivatives CALIFORNIA PACIFIC MEDICAL CENTER (US) 2021-12-29 EP claimed
EP-2388003-A2 Colchicine derivatives California Pacific Medical Center (US) 2011-11-23 EP claimed
JP-4699373-B2 2011-06-08 JP claimed
EP-1617843-A2 COLCHICINE DERIVATIVES California Pacific Medical Center (US) 2006-01-25 EP claimed
WO-2005007076-A2 COLCHICINE DERIVATIVES CALIFORNIA PACIFIC MEDICAL CENTER (US) 2005-01-27 WO claimed
US-6825236-B2 ACTIVE AGAINST TUMORS IN MICE AND ARE GENERALLY WELL TOLERATED CALIFORNIA PACIFIC MEDICAL CENTER 2004-11-30 US claimed
US-20040204370-A1 COLCHICINE DERIVATIVES SUTTER WEST BAY HOSPITALS, DBA CALIFORNIA PACIFIC MEDICAL CENTER 2004-10-14 US claimed
EP-2388003-B1 Colchicine derivatives CALIFORNIA PACIFIC MEDICAL CENTER (US) 2021-12-29 EP disclosed
EP-3207929-A2 COLCHICINE DERIVATIVES California Pacific Medical Center (US) 2017-08-23 EP disclosed
EP-1617843-B1 COLCHICINE DERIVATIVES CALIFORNIA PACIFIC MEDICAL CENTER (US) 2016-12-21 EP disclosed
EP-2388003-A2 Colchicine derivatives California Pacific Medical Center (US) 2011-11-23 EP disclosed
EP-1617843-A2 COLCHICINE DERIVATIVES California Pacific Medical Center (US) 2006-01-25 EP disclosed
WO-2005007076-A2 COLCHICINE DERIVATIVES CALIFORNIA PACIFIC MEDICAL CENTER (US) 2005-01-27 WO disclosed
US-6825236-B2 ACTIVE AGAINST TUMORS IN MICE AND ARE GENERALLY WELL TOLERATED CALIFORNIA PACIFIC MEDICAL CENTER 2004-11-30 US disclosed
US-20040204370-A1 COLCHICINE DERIVATIVES SUTTER WEST BAY HOSPITALS, DBA CALIFORNIA PACIFIC MEDICAL CENTER 2004-10-14 US 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-20040204370-A1 COLCHICINE DERIVATIVES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCCS, NAP1L4 CCR1 284/4885CCR5 853/4885CCR8 724/4885

“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.