SCHEMBL7425735

SCHEMBL7425735

c1ccc(-n2cnc3c2CCCC3)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 5/20 0.52
▸ PDE3A Q14432 5/20 0.52
▸ PDE2A O00408 2/20 0.52
▸ PDE1A P54750 1/20 0.47
▸ PDE1B Q01064 1/20 0.47
▸ PDE1C Q14123 1/20 0.47
▸ PDK2 Q15119 2/20 0.44
▸ CPB2 Q96IY4 1/20 0.44
▸ P2RX7 Q99572 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ CYP11B2 P19099 1/20 0.42
▸ PTGS1 P23219 2/20 0.39
▸ PTGS2 P35354 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ FGFR1 P11362 2/20 0.38
▸ SRC P12931 1/20 0.38

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
SCHEMBL17185938 0.82 PDE3B (0.53) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL11073696 0.82 PDE3B (0.50) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL16111137 0.81 HTR2C (0.43) PDE3BPDE3APDE2APDK2CPB2
SCHEMBL7293060 0.80 PDE3B (0.54) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL11006142 0.77 PDE3B (0.52) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL17868200 0.76 PDK2 (0.41) PDE3BPDE3APDE2APDK2CPB2
SCHEMBL10095080 0.76 PDK2 (0.41) PDE3BPDE3APDE2APDK2CPB2
SCHEMBL944218 0.76 FGFR1 (0.45) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7381531 0.76 CYP11B2 (0.52) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL16135324 0.75 DRD4 (0.47) PDK2P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6200991-B1 M3-MUSCARINIC OR 5-HT SEROTONINERGIC RECEPTOR ANTAGONISTS; IRRITABLE BOWEL SYNDROME, INCONTINENCE, COGNITION ACTIVATORS; RESPIRATORY SYSTEM DISORDERS SANOFI-SYNTHELABO (FR) 2001-03-13 — — US disclosed
EP-1032569-A1 IMIDAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF SANOFI-SYNTHELABO (FR) 2000-09-06 — — EP disclosed
WO-1999031097-A1 IMIDAZOL DERIVATIVES AS MUSCARINIC M3 RECEPTOR ANTAGONISTS SANOFI-SYNTHELABO (FR) 1999-06-24 — — WO disclosed
WO-1999025710-A1 IMIDAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF SANOFI-SYNTHELABO (FR) 1999-05-27 — — WO disclosed
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