SCHEMBL18160809

SCHEMBL18160809

CCC(C)(N)Cc1cc(C(C)(C)C)ccn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.34
POLB P06746 2/20 0.33
CYP1A2 P05177 1/20 0.33
ALDH1A1 P00352 4/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 3/20 0.31
RAB9A P51151 3/20 0.31
SCN10A Q9Y5Y9 2/20 0.31
LNPEP Q9UIQ6 1/20 0.31
KCNH2 Q12809 1/20 0.30
MAPT P10636 2/20 0.30
SREBF2 Q12772 1/20 0.30
NOS3 P29474 2/20 0.30
NOS2 P35228 2/20 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
SCHEMBL19214819 0.87 NOS3 (0.46) ALDH1A1KDM4ELMNACYP3A4TSHR
SCHEMBL19214824 0.84 KIF11 (0.37) KIF11POLBCYP1A2ALDH1A1MEN1
SCHEMBL10034535 0.80 KIF11 (0.39) KIF11POLBCYP1A2ALDH1A1MEN1
SCHEMBL1908532 0.78 POLB (0.46) KIF11POLBCYP1A2ALDH1A1MEN1
SCHEMBL18924325 0.77 KIF11 (0.37) KIF11POLBALDH1A1MEN1KMT2A
SCHEMBL1908511 0.77 KIF11 (0.39) KIF11POLBCYP1A2ALDH1A1MEN1
SCHEMBL16544502 0.75 KDM4E (0.50) KIF11POLBALDH1A1MEN1KMT2A
SCHEMBL19214820 0.74 CYP3A4 (0.36) POLBCYP1A2ALDH1A1MEN1KMT2A
SCHEMBL18733002 0.74 HRH1 (0.46) CYP1A2ALDH1A1LMNANPC1RAB9A
SCHEMBL21475711 0.73 KIF11 (0.41) KIF11POLBALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160304730-A1 NEAR INFRARED RADIATION-ABSORBING COMPOSITION, NEAR INFRARED RADIATION CUT-OFF FILTER AND PRODUCTION METHOD THEREFOR, AND CAMERA MODULE AND PRODUCTION METHOD THEREFOR FUJIFILM CORPORATION (JP) 2016-10-20 US disclosed