SCHEMBL6865467

SCHEMBL6865467

CCN(/C=C/N(Cc1nc2ccccc2n1C)Cc1nc2ccccc2n1C)Cc1nc2ccccc2n1C

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.55
USP2 O75604 1/20 0.55
LMNA P02545 2/20 0.50
PKM P14618 2/20 0.50
CYP2D6 P10635 1/20 0.49
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
TSHR P16473 2/20 0.47
MAPT P10636 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
PDE10A Q9Y233 1/20 0.46
GFER P55789 1/20 0.45

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
SCHEMBL6868613 0.87 SMN1; SMN2 (0.57) SMN1; SMN2USP2LMNAPKMCYP2D6
SCHEMBL6866036 0.87 SMN1; SMN2 (0.53) SMN1; SMN2USP2LMNAPKMNPC1
SCHEMBL6859213 0.85 SMN1; SMN2 (0.51) SMN1; SMN2USP2LMNAPKMCYP2D6
SCHEMBL6866321 0.82 SMN1; SMN2 (0.49) SMN1; SMN2USP2LMNANPC1RAB9A
SCHEMBL31248989 0.79 SMN1; SMN2 (0.65) SMN1; SMN2USP2LMNAPKMCYP2D6
SCHEMBL3746825 0.79 SMN1; SMN2 (0.65) SMN1; SMN2USP2LMNAPKMCYP2D6
SCHEMBL14685205 0.78 SMN1; SMN2 (0.68) SMN1; SMN2USP2LMNAPKMCYP2D6
SCHEMBL5610013 0.78 SMN1; SMN2 (0.68) SMN1; SMN2USP2LMNAPKMCYP2D6
SCHEMBL6865472 0.78 SMN1; SMN2 (0.56) SMN1; SMN2USP2LMNAPKMCYP2D6
SCHEMBL11995138 0.76 SMN1; SMN2 (0.61) SMN1; SMN2USP2LMNAPKMCYP2D6

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
EP-1008645-B1 Detergent bleaching compositions UNILEVER PLC (GB) 2004-07-21 EP disclosed
US-6165963-A Detergent bleaching composition comprising pentadentate ligand derivatives UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. (US) 2000-12-26 US disclosed
EP-1008645-A1 Detergent bleaching compositions UNILEVER PLC (GB) 2000-06-14 EP disclosed
WO-2000027975-A1 DETERGENT BLEACHING COMPOSITION UNILEVER PLC (GB) 2000-05-18 WO disclosed