SCHEMBL8261520

SCHEMBL8261520

C=CO/C(=C\C)c1ccc(Cl)c(-c2ccc(NC(=O)c3ccncc3F)s2)c1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ IL2 P60568 5/20 0.38
▸ ABL1 P00519 3/20 0.37
▸ STIM1 Q13586 2/20 0.36
▸ ORAI1 Q96D31 2/20 0.36
▸ CYP11B2 P19099 1/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ CSF1R P07333 2/20 0.33
▸ F10 P00742 1/20 0.33
▸ RORC P51449 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CSNK1D P48730 1/20 0.32
▸ CSNK1E P49674 1/20 0.32

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
SCHEMBL8261524 0.91 IL2 (0.42) IL2CYP11B2CSF1RF10RORC
SCHEMBL8263043 0.91 IL2 (0.49) IL2ABL1STIM1ORAI1L3MBTL1
SCHEMBL8261516 0.89 IL2 (0.46) IL2STIM1ORAI1CNR1CSF1R
SCHEMBL8261522 0.88 IL2 (0.37) IL2ABL1STIM1ORAI1CNR1
SCHEMBL8263042 0.88 IL2 (0.40) IL2ABL1STIM1ORAI1CNR1
SCHEMBL8260064 0.83 IL2 (0.46) IL2ABL1STIM1ORAI1CYP11B2
SCHEMBL8262105 0.82 IL2 (0.47) IL2ABL1CYP11B2CSF1RF10
SCHEMBL8262095 0.79 IL2 (0.58) IL2ABL1STIM1ORAI1
SCHEMBL8261521 0.79 IL2 (0.41) IL2CYP11B2CSF1RF10RORC
SCHEMBL8262993 0.79 IL2 (0.47) IL2ABL1STIM1ORAI1

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
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