SCHEMBL5789205

SCHEMBL5789205

CCc1nn(C)c(CC)c1Cc1cc(Cl)cc(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 9/20 0.40
FPR2 P25090 1/20 0.34
PROKR1 Q8TCW9 1/20 0.34
NMT1 P30419 1/20 0.33
MAPK8 P45983 1/20 0.33
MAPK9 P45984 1/20 0.33
MAPK10 P53779 1/20 0.33
CCR2 P41597 2/20 0.32
CCR5 P51681 1/20 0.32
GAA P10253 1/20 0.31
CCNE2 O96020 1/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
ADCY10 Q96PN6 2/20 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
SCHEMBL5789203 0.83 PTGDR2 (0.39) PTGDR2CCR2CCR5CCNE2CDK4
SCHEMBL5749535 0.81 PTGDR2 (0.43) PTGDR2
SCHEMBL5750211 0.81 PTGDR2 (0.46) PTGDR2
SCHEMBL5751408 0.81 PTGDR2 (0.47) PTGDR2
SCHEMBL5751780 0.79 PTGDR2 (0.42) PTGDR2
SCHEMBL5748535 0.79 PTGDR2 (0.44) PTGDR2
SCHEMBL5753886 0.78 PTGDR2 (0.53) PTGDR2
SCHEMBL5749373 0.76 PTGDR2 (0.64) PTGDR2
SCHEMBL5753104 0.76 PTGDR2 (0.47) PTGDR2
SCHEMBL5752040 0.75 PTGDR2 (0.48) PTGDR2

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-1299361-B1 PYRAZOLE DERIVATIVES PFIZER LTD (GB) 2006-07-19 EP claimed