SCHEMBL2146301

SCHEMBL2146301

c1cn(C2CCCCC2)c(C2CCCCC2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
CCNE1 P24864 3/20 0.36
CDK2 P24941 3/20 0.36
CCNT1 O60563 1/20 0.36
CDK1 P06493 1/20 0.36
CDK4 P11802 1/20 0.36
CCNB1 P14635 1/20 0.36
CCNA2 P20248 1/20 0.36
CCND1 P24385 1/20 0.36
CDK9 P50750 1/20 0.36
PI4KA P42356 3/20 0.36
PI4K2B Q8TCG2 3/20 0.36
PI4K2A Q9BTU6 3/20 0.36
PI4KB Q9UBF8 3/20 0.36
ADORA2A P29274 2/20 0.36
HCAR1 Q9BXC0 3/20 0.34
TP53 P04637 1/20 0.34
THRB P10828 1/20 0.34
ADORA3 P0DMS8 1/20 0.33
ADORA1 P30542 1/20 0.33

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
SCHEMBL22940000 1.00 LMNA (0.38) LMNACCNE1CDK2CCNT1CDK1
Hydrochloric Acid SCHEMBL16341570 0.98 LMNA (0.37) LMNACCNE1CDK2CCNT1CDK1
SCHEMBL4870076 0.98 LMNA (0.39) LMNACCNE1CDK2CCNT1CDK1
SCHEMBL21577450 0.86 KCNH2 (0.34) LMNAADORA2A
SCHEMBL27963399 0.75 LMNA (0.35) LMNAPI4KAPI4K2BPI4K2API4KB
SCHEMBL12903263 0.74 CCNE1 (0.46) CCNE1CDK2CCNT1CDK1CDK4
SCHEMBL11015922 0.74 KDM4E (0.40) LMNAPI4KAPI4K2BPI4K2API4KB
SCHEMBL9442396 0.74 PI4KA (0.37) LMNAPI4KAPI4K2BPI4K2API4KB
SCHEMBL3237878 0.74 PI4KA (0.37) LMNAPI4KAPI4K2BPI4K2API4KB
SCHEMBL4964108 0.74 KDM4E (0.40) LMNAPI4KAPI4K2BPI4K2API4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007004165-A2 PROCESS FOR THE PREPARATION OF PERINDOPRIL RANBAXY LABORATORIES LIMITED (IN) 2007-01-11 WO claimed
CN-105683178-B triazine derivatives 卡尔那生物科学株式会社 2019-04-12 CN disclosed
EP-2542532-B1 METHOD FOR PREPARING CARBENE IN SOLUTION AND STABLE FORM OF CARBENE OBTAINED BY SAID METHOD BLUESTAR SILICONES FRANCE (FR) 2018-01-03 EP disclosed
EP-1306131-B1 Cross-coupling process using a catalyst comprising a cyclic nitrogen ligand SUMITOMO CHEMICAL CO (JP) 2016-12-07 EP disclosed
EP-2542532-A1 METHOD FOR PREPARING CARBENE IN SOLUTION, NOVEL STABLE FORM OF CARBENE OBTAINED IN PARTICULAR BY MEANS OF SAID METHOD, AND USES THEREOF IN CATALYSIS Bluestar Silicones France SAS (FR) 2013-01-09 EP disclosed
WO-2011083146-A1 METHOD FOR PREPARING CARBENE IN SOLUTION, NOVEL STABLE FORM OF CARBENE OBTAINED IN PARTICULAR BY MEANS OF SAID METHOD, AND USES THEREOF IN CATALYSIS BLUESTAR SILICONES FRANCE SAS (FR) 2011-07-14 WO disclosed
WO-2007004165-A2 PROCESS FOR THE PREPARATION OF PERINDOPRIL RANBAXY LABORATORIES LIMITED (IN) 2007-01-11 WO disclosed
US-20060111593-A1 Coupling catalyst and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2006-05-25 US disclosed
US-7041856-B2 Coupling catalyst and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-05-09 US disclosed
US-20050256167-A1 Preparation and use of imidazole derivatives for treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2005-11-17 US disclosed
US-6960601-B2 Preparation and use of imidazole derivatives for treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2005-11-01 US disclosed
US-20030162950-A1 Coupling catalyst and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2003-08-28 US disclosed
EP-1306131-A2 Cross-Coupling catalyst comprising a cyclic nitrogen ligand and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-05-02 EP 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-20030162950-A1 Coupling catalyst and process using the same NOD1, PYM1, C9 LMNA 1888/4885CCNE1 526/4885CDK2 673/4885
US-20050256167-A1 Preparation and use of imidazole derivatives for treatment of obesity GPR119, GIPR, PGC LMNA 4010/4885CCNE1 3647/4885CDK2 1398/4885
US-20060111593-A1 Coupling catalyst and process using the same RPL22, C9, RBM22 LMNA 1071/4885CCNE1 404/4885CDK2 514/4885

“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.