SCHEMBL19478291

SCHEMBL19478291

Cc1cc(Cl)ccc1-c1cc(C#N)cc2cc(C(N)=O)[nH]c12

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 1/20 0.41
▸ MAP2 P11137 2/20 0.38
▸ HRH4 Q9H3N8 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.36
▸ FFAR1 O14842 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ JAK2 O60674 5/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NOTUM Q6P988 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CNR2 P34972 1/20 0.32
▸ NSD2 O96028 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
SCHEMBL16571189 0.88 KDM4E (0.43) MAP2KDM4EFFAR1JAK2MAPT
SCHEMBL16571203 0.86 GRM2 (0.41) GRM2MAP2HRH4JAK2
SCHEMBL16571716 0.83 MAP2 (0.43) GRM2MAP2KDM4EPPARGSMN1; SMN2
SCHEMBL19478200 0.81 CCNC (0.48) —
SCHEMBL19478158 0.79 GRM2 (0.45) GRM2
SCHEMBL16571044 0.79 MPL (0.39) GRM2MAPT
SCHEMBL16571180 0.77 SLC22A12 (0.42) GRM2MAP2KDM4E
SCHEMBL16571281 0.77 BRD4 (0.37) GRM2
SCHEMBL16571158 0.76 ALOX15 (0.49) KDM4EMEN1LMNAGAAHPGD
SCHEMBL16580061 0.75 PARP1 (0.39) GRM2MAP2JAK2L3MBTL1MEN1

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-3044207-B1 INDOL-CARBOXAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2017-10-18 — — EP disclosed
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