SCHEMBL2615324

SCHEMBL2615324

Cc1ccc(C2=NC(O)C(=O)Nc3ccc(F)cc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
MEN1 O00255 1/20 0.56
ALB P02768 1/20 0.56
KMT2A Q03164 1/20 0.56
PGR P06401 1/20 0.46
GABRA1 P14867 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42
CCNE2 O96020 2/20 0.40
CCNE1 P24864 2/20 0.40
CDK2 P24941 2/20 0.40
CCKBR P32239 3/20 0.40
CCKAR P32238 2/20 0.40
CHRM1 P11229 3/20 0.40
DRD2 P14416 3/20 0.39
DRD1 P21728 2/20 0.39
KCNH2 Q12809 1/20 0.39
KDR P35968 1/20 0.39

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
SCHEMBL13284385 0.92 LMNA (0.61) LMNAMEN1ALBKMT2APGR
SCHEMBL2615325 0.87 LMNA (0.73) LMNAMEN1ALBKMT2APGR
SCHEMBL2615323 0.85 LMNA (0.77) LMNAMEN1ALBKMT2APGR
SCHEMBL2615321 0.84 MEN1 (0.42) LMNAMEN1ALBKMT2AGABRA1
SCHEMBL13284383 0.82 LMNA (0.77) LMNAMEN1ALBKMT2APGR
SCHEMBL14160193 0.82 LMNA (0.73) LMNAMEN1ALBKMT2APGR
SCHEMBL10974232 0.79 LMNA (0.52) LMNAMEN1ALBKMT2APGR
SCHEMBL13284429 0.79 LMNA (0.62) LMNAMEN1ALBKMT2APGR
SCHEMBL11473985 0.78 GABRA1 (0.43) LMNAMEN1ALBKMT2AGABRA1
SCHEMBL2631488 0.77 LMNA (0.78) LMNAMEN1ALBKMT2APGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120095217-A1 FLUORINE CONTAINING COMPOUNDS AND METHODS OF USE THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2012-04-19 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-20120095217-A1 FLUORINE CONTAINING COMPOUNDS AND METHODS OF USE THEREOF FLI1, CDC73, FOS LMNA 1375/4885MEN1 81/4885ALB 4096/4885

“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.