SCHEMBL30802465

SCHEMBL30802465

Fc1ccc(CNC2CC2)c(F)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.63
ACHE P22303 2/20 0.63
BACE1 P56817 2/20 0.63
KDM4E B2RXH2 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CXCR3 P49682 2/20 0.46
PABPC1 P11940 1/20 0.44
IDO1 P14902 2/20 0.43
AGXT P21549 2/20 0.43
OPRL1 P41146 3/20 0.42
SIGMAR1 Q99720 1/20 0.42
BRD4 O60885 1/20 0.41
GRM2 Q14416 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
SLC6A4 P31645 1/20 0.40
P2RX7 Q99572 1/20 0.40
KDM1A O60341 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
SCHEMBL24079779 0.91 BCHE (0.59) BCHEACHEBACE1KDM4ESMN1; SMN2
SCHEMBL22570091 0.89 BCHE (0.54) BCHEACHEBACE1KDM4ESMN1; SMN2
SCHEMBL24267565 0.89 BCHE (0.54) BCHEACHEBACE1KDM4ESMN1; SMN2
SCHEMBL24619033 0.89 BCHE (0.54) BCHEACHEBACE1KDM4ESMN1; SMN2
SCHEMBL25570743 0.89 BCHE (0.56) BCHEACHEBACE1KDM4ESMN1; SMN2
SCHEMBL25091041 0.88 BACE1 (0.53) BCHEACHEBACE1KDM4ESMN1; SMN2
SCHEMBL24267939 0.88 BCHE (0.53) BCHEACHEBACE1KDM4ESMN1; SMN2
SCHEMBL25091289 0.87 BCHE (0.52) BCHEACHEBACE1KDM4ECXCR3
SCHEMBL20766753 0.86 BCHE (0.64) BCHEACHEBACE1KDM4ESMN1; SMN2
SCHEMBL29546328 0.86 BCHE (0.64) BCHEACHEBACE1KDM4ESMN1; SMN2

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
CN-117561244-A Isoindolinone compounds and uses thereof 杭州格博生物医药有限公司 2024-02-13 CN disclosed