SCHEMBL10330636

SCHEMBL10330636

CCCCNc1cccc2c1-c1nc-2nc2[nH]c(nc3nc(nc4[nH]c(n1)c1cccc(NCCCC)c41)-c1cccc(NCCCC)c1-3)c1cccc(NCCCC)c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 5/20 0.46
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
RGS12 O14924 1/20 0.41
USP2 O75604 1/20 0.41
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TLR9 Q9NR96 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NR4A2 P43354 1/20 0.39
DYRK3 O43781 1/20 0.37
RPS6KB1 P23443 1/20 0.37
EPHA2 P29317 1/20 0.37
FLT4 P35916 1/20 0.37
CSNK2A1 P68400 1/20 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
SCHEMBL9181704 0.86 UTS2R (0.46) UTS2RMEN1KMT2APOLBMAPT
SCHEMBL9182220 0.86 UTS2R (0.46) UTS2RMEN1KMT2APOLBMAPT
SCHEMBL9181233 0.83 PDE5A (0.42) UTS2RMEN1KMT2APOLBMAPT
SCHEMBL10330637 0.79 TDP1 (0.39) MEN1KMT2APOLBMAPTUSP2
SCHEMBL6543749 0.76 ALDH1A1 (0.45) UTS2RMEN1KMT2APOLBMAPT
SCHEMBL6543648 0.75 UTS2R (0.38) UTS2RMEN1KMT2APOLBMAPT
SCHEMBL24733280 0.75 MEN1 (0.34) MEN1KMT2AATMTDP1ELANE
SCHEMBL24733282 0.75 MEN1 (0.34) MEN1KMT2AATMTDP1ELANE
SCHEMBL9184217 0.71 SLC2A1 (0.45) UTS2RNPSR1ELANECYP3A4CYP2D6
SCHEMBL9185132 0.71 SLC2A1 (0.45) UTS2RNPSR1ELANECYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8221657-B2 Near infrared absorbing phthalocyanines and their use BASF SE (DE) 2012-07-17 US disclosed
US-20110236642-A1 NEAR INFRARED ABSORBING PHTHALOCYANINES AND THEIR USE PERI FRANCESCA 2011-09-29 US disclosed
EP-2118115-B1 NEAR INFRARED ABSORBING PHTHALOCYANINES AND THEIR USE BASF SE (DE) 2010-08-11 EP disclosed
US-20100032608-A1 NEAR INFRARED ABSORBING PHTHALOCYANINES AND THEIR USE CIBA CORPORATION (US) 2010-02-11 US disclosed
US-20100032608-A1 NEAR INFRARED ABSORBING PHTHALOCYANINES AND THEIR USE CIBA CORPORATION (US) 2010-02-11 US disclosed
WO-2008083918-A1 NEAR INFRARED ABSORBING PHTHALOCYANINES AND THEIR USE CIBA HOLDING INC. (CH) 2008-07-17 WO disclosed