SCHEMBL8262107

SCHEMBL8262107

C=CS/C(=C\C)c1ccc(C)c(-c2ccc(NC(=O)c3ccncc3C)s2)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ IL2 P60568 5/20 0.45
▸ MAPK14 Q16539 4/20 0.32
▸ CSF1R P07333 3/20 0.32
▸ ABL1 P00519 3/20 0.32
▸ KDR P35968 2/20 0.32
▸ POLQ O75417 1/20 0.32
▸ LCK P06239 1/20 0.32
▸ CYP11B2 P19099 1/20 0.31
▸ MAPK13 O15264 2/20 0.31
▸ MAPK12 P53778 2/20 0.31
▸ MAPK11 Q15759 2/20 0.31
▸ S1PR2 O95136 1/20 0.31
▸ S1PR4 O95977 1/20 0.31
▸ KIT P10721 1/20 0.31
▸ BLK P51451 1/20 0.31
▸ BTK Q06187 1/20 0.31
▸ IKBKE Q14164 1/20 0.31
▸ TBK1 Q9UHD2 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
SCHEMBL8262099 0.92 IL2 (0.47) IL2MAPK14CSF1RABL1KDR
SCHEMBL8262625 0.88 IL2 (0.44) IL2MAPK14CSF1RABL1KDR
SCHEMBL8263029 0.86 IL2 (0.44) IL2MAPK14CSF1RABL1KDR
SCHEMBL8261515 0.84 IL2 (0.55) IL2MAPK14ABL1MAPK13MAPK12
SCHEMBL8262105 0.84 IL2 (0.47) IL2MAPK14CSF1RABL1KDR
SCHEMBL8264012 0.82 IL2 (0.49) IL2MAPK14CSF1RABL1KDR
SCHEMBL8256822 0.82 IL2 (0.46) IL2ABL1
SCHEMBL8262623 0.81 IL2 (0.46) IL2MAPK14CSF1RABL1KDR
SCHEMBL8261523 0.80 IL2 (0.42) IL2
SCHEMBL8263040 0.79 IL2 (0.46) IL2ABL1IKBKETBK1

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
WO-2006081389-A1 THIOPHENE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2006-08-03 — — WO disclosed
Send feedback