SCHEMBL7967474

SCHEMBL7967474

COC(=O)c1c(Cl)c(-c2cccnc2F)n2c1C=CCC2

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 7/20 0.35
IDO1 P14902 2/20 0.34
CDC7 O00311 3/20 0.33
DBF4 Q9UBU7 3/20 0.33
HSP90B1 P14625 5/20 0.33
FPR1 P21462 1/20 0.33
FPR2 P25090 1/20 0.33
TDP2 O95551 1/20 0.32
BDKRB1 P46663 2/20 0.32
GSK3B P49841 1/20 0.32
DHODH Q02127 1/20 0.31

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
SCHEMBL7965862 0.90 IDO1 (0.35) HSP90AA1IDO1HSP90B1TDP2DHODH
SCHEMBL7965052 0.89 DHODH (0.36) IDO1CDC7DBF4TDP2BDKRB1
SCHEMBL7962199 0.89 DHODH (0.33) FPR1FPR2DHODH
SCHEMBL7967142 0.88 IDO1 (0.34) IDO1CDC7DBF4TDP2BDKRB1
SCHEMBL8329857 0.87 DHODH (0.38) IDO1FPR1FPR2DHODH
SCHEMBL7967778 0.86 PLAU (0.33) FPR1FPR2DHODH
SCHEMBL7952777 0.86 IDO1 (0.35) HSP90AA1IDO1CDC7DBF4HSP90B1
SCHEMBL7967763 0.85 HCRTR1 (0.35) IDO1CDC7DBF4TDP2BDKRB1
SCHEMBL7961118 0.84 HSP90AA1 (0.35) HSP90AA1IDO1CDC7DBF4HSP90B1
SCHEMBL7961829 0.82 IDO1 (0.35) HSP90AA1IDO1CDC7DBF4HSP90B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6207675-B1 FOR PROPHYLAXIS AND THERAPY OF DISEASES IN WHICH ARE INVOLVED VIRUSES OF THE HERPES FAMILY AND/OR CYTOKINES IN PARTICULAR TUMOR NERCOSIS FACTOR-ALPHA RHONE-POULENC RORER S.A. (FR) 2001-03-27 US claimed
US-6207675-B1 FOR PROPHYLAXIS AND THERAPY OF DISEASES IN WHICH ARE INVOLVED VIRUSES OF THE HERPES FAMILY AND/OR CYTOKINES IN PARTICULAR TUMOR NERCOSIS FACTOR-ALPHA RHONE-POULENC RORER S.A. (FR) 2001-03-27 US disclosed