SCHEMBL6203850

SCHEMBL6203850

CCc1cccnc1CC(N)C(N)(Cc1ncccc1CC)Cc1ncccc1CC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL825251 0.79 NOS3 (0.38) LMNAL3MBTL1
SCHEMBL5968787 0.75 L3MBTL1 (0.33) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
SCHEMBL18566486 0.74 PDE3B (0.41) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL28470006 0.73 PDE3B (0.41) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
SCHEMBL242311 0.71 GABRA1 (0.41) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
SCHEMBL17778287 0.70 DPP4 (0.40) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
Ammonia Solution, Strong SCHEMBL25385979 0.69 GABRA1 (0.39) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
SCHEMBL5786722 0.69 GABRA1 (0.39) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL28665184 0.68 GABRA1 (0.38) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1
Formamide SCHEMBL10696206 0.67 ALDH1A1 (0.35) GABRA1GABRB2LMNASMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506175-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-16 EP disclosed
WO-2003097609-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-11-27 WO disclosed
EP-1341893-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2003-09-10 EP disclosed
WO-2002048307-A1 ENZYMATIC DETERGENT COMPOSITIONS UNILEVER N.V. (NL) 2002-06-20 WO disclosed
US-20020013246-A1 Composition and method for bleaching laundry fabrics UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-01-31 US disclosed
EP-1109884-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-06-27 EP disclosed
WO-2000060043-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2000-10-12 WO disclosed
WO-2000012667-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2000-03-09 WO disclosed