SCHEMBL7352500

SCHEMBL7352500

Cc1csc(-c2nc3n(c2-c2ccncc2)CCC3)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.51
TGFBR1 P36897 3/20 0.43
ATM Q13315 1/20 0.39
GABRA1 P14867 6/20 0.39
GABRG2 P18507 6/20 0.39
GABRB3 P28472 6/20 0.39
GABRA3 P34903 6/20 0.39
GABRA2 P47869 3/20 0.39
GABRA5 P31644 2/20 0.39
GABRA4 P48169 1/20 0.39
GABRA6 Q16445 1/20 0.39
MAPK13 O15264 2/20 0.38
MAPK12 P53778 2/20 0.38
MAPK11 Q15759 2/20 0.38
MAPK14 Q16539 2/20 0.38
ALDH1A1 P00352 2/20 0.37
HTT P42858 2/20 0.37
THRB P10828 1/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
KDM4E B2RXH2 3/20 0.37

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
SCHEMBL9700106 0.96 PDE10A (0.47) PDE10ATGFBR1ATMGABRA1GABRG2
SCHEMBL9524943 0.90 TGFBR1 (0.46) PDE10ATGFBR1ATMGABRA1GABRG2
SCHEMBL7377237 0.90 PDE10A (0.51) PDE10ATGFBR1ATMGABRA1GABRG2
SCHEMBL9524516 0.87 PDE10A (0.41) PDE10ATGFBR1ATMGABRA1GABRG2
SCHEMBL11473387 0.87 SMN1; SMN2 (0.39) PDE10ATGFBR1ATMALDH1A1HTT
SCHEMBL7376928 0.84 PDE10A (0.46) PDE10ATGFBR1ATMGABRA1GABRG2
SCHEMBL9297762 0.83 MAPK14 (0.52) PDE10ATGFBR1GABRA1GABRG2GABRB3
SCHEMBL9198377 0.82 PDE10A (0.45) PDE10ATGFBR1ATMGABRA1GABRG2
SCHEMBL7378265 0.82 PDE10A (0.45) PDE10ATGFBR1ATMGABRA1GABRG2
SCHEMBL9700065 0.82 PDE10A (0.44) PDE10ATGFBR1ATMGABRA1GABRG2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1091960-A1 BIFUNCTIONAL ANTAGONISTS OF CYTOKINE-SENSITIVE PROTEIN KINASE ACTIVATION CASCADES AND METHODS FOR USE AS ANTI-INFLAMMATORY AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-04-18 EP claimed
WO-2000000491-A1 BIFUNCTIONAL ANTAGONISTS OF CYTOKINE-SENSITIVE PROTEIN KINASE ACTIVATION CASCADES AND METHODS FOR USE AS ANTI-INFLAMMATORY AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-01-06 WO claimed
EP-0306300-B1 Pyrrolo(1,2-a)imidazole and imidazo(1,2-a)pyridine derivatives and their use as 5-lipoxygenase pathway inhibitors SMITHKLINE BEECHAM CORP (US) 1995-05-03 EP claimed
EP-0561898-A1 NOVEL PROCESS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-09-29 EP claimed
US-5145858-A Antiinflammatory SMITHKLINE BEECHAM CORP. (US) 1992-09-08 US claimed
WO-1992010499-A1 NOVEL PROCESS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-06-25 WO claimed
EP-0411754-A2 Medicament for the inhibition of interleukin-1 or tumor necrosis factor production by monocytes and/or macrophages SMITHKLINE BEECHAM CORPORATION (US) 1991-02-06 EP claimed
WO-1991000092-A1 INHIBITION OF INTERLEUKIN-1 AND TUMOR NECROSIS FACTOR PRODUCTION BY MONOCYTES AND/OR MACROPHAGES SMITHKLINE BEECHAM CORPORATION (US) 1991-01-10 WO claimed
WO-1990015534-A1 MONOKINE ACTIVITY INTERFERENCE SMITHKLINE BEECHAM CORPORATION (US) 1990-12-27 WO claimed
EP-0403251-A2 Monokine activity interference SMITHKLINE BEECHAM CORPORATION (US) 1990-12-19 EP claimed
EP-0306300-A2 Pyrrolo(1,2-a)imidazole and imidazo(1,2-a)pyridine derivatives and their use as 5-lipoxygenase pathway inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1989-03-08 EP claimed
JP-1071876-A None JP disclosed
EP-0306300-B1 Pyrrolo(1,2-a)imidazole and imidazo(1,2-a)pyridine derivatives and their use as 5-lipoxygenase pathway inhibitors SMITHKLINE BEECHAM CORP (US) 1995-05-03 EP disclosed
EP-0533837-A4 INHIBITION OF 5-LIPOXYGENASE AND CYCLOOXYGENASE PATHWAY MEDIATED DISEASES SMITHKLINE BEECHAM CORP (US) 1994-11-17 EP disclosed
US-5317019-A Antiinflammatory agents SMITHKLINE BEECHAM CORP. (US) 1994-05-31 US disclosed
WO-1990015534-A1 MONOKINE ACTIVITY INTERFERENCE SMITHKLINE BEECHAM CORPORATION (US) 1990-12-27 WO disclosed
EP-0403251-A2 Monokine activity interference SMITHKLINE BEECHAM CORPORATION (US) 1990-12-19 EP disclosed
WO-1990003789-A1 PYRROLO[1,2-a]IMIDAZOLE AND IMIDAZO[1,2-a]PYRIDINE DERIVATIVES AND THEIR USE AS 5-LYPOXYGENASE PATHWAY INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1990-04-19 WO disclosed
EP-0364204-A1 Pyrrolo[1,2-a]imidazole and imidazo[1,2-a]pyridine derivatives and their use as 5-lipoxygenase pathway inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1990-04-18 EP disclosed
EP-0306300-A2 Pyrrolo(1,2-a)imidazole and imidazo(1,2-a)pyridine derivatives and their use as 5-lipoxygenase pathway inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1989-03-08 EP disclosed