SCHEMBL14302000

SCHEMBL14302000

CCc1ccccc1-c1cnn2ccc(Nc3ccc(C)c(NS(C)(=O)=O)c3)nc12

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FYN P06241 5/20 0.68
CCNT1 O60563 2/20 0.45
CDK9 P50750 2/20 0.45
BACE1 P56817 4/20 0.45
RET P07949 1/20 0.44
PIM1 P11309 5/20 0.43
MAPT P10636 1/20 0.39
PTGS1 P23219 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL4339119 0.93 FYN (0.69) FYNCCNT1CDK9BACE1RET
SCHEMBL102960 0.86 FYN (0.67) FYNCCNT1CDK9BACE1RET
SCHEMBL14308695 0.83 FYN (0.65) FYNCCNT1CDK9BACE1RET
SCHEMBL4333481 0.83 FYN (0.68) FYNCCNT1CDK9BACE1RET
SCHEMBL4340636 0.83 FYN (0.83) FYNCCNT1CDK9BACE1RET
SCHEMBL14302401 0.83 FYN (0.83) FYNCCNT1CDK9BACE1RET
SCHEMBL4333443 0.82 FYN (0.74) FYNCCNT1CDK9BACE1RET
SCHEMBL4344917 0.82 FYN (0.68) FYNCCNT1CDK9BACE1RET
SCHEMBL4330999 0.81 FYN (0.82) FYNCCNT1CDK9BACE1RET
SCHEMBL4334679 0.81 FYN (0.65) FYNCCNT1CDK9BACE1RET

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
EP-1873157-A1 Pyrazolopyrimidines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same Bayer Schering Pharma Aktiengesellschaft (DE) 2008-01-02 EP disclosed