SCHEMBL16558113

SCHEMBL16558113

C1=CN2c3ccccc3CC2N1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.37
HPGD P15428 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SLC6A2 P23975 2/20 0.35
MTNR1A P48039 2/20 0.35
MTNR1B P49286 2/20 0.35
NOTUM Q6P988 3/20 0.34
AADAT Q8N5Z0 2/20 0.34
GOT1 P17174 1/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
KYAT1 Q16773 1/20 0.34
KYAT3 Q6YP21 1/20 0.34
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL15695452 0.78 HTR2A (0.39) SRD5A1SLC6A2MTNR1AMTNR1BNOTUM
SCHEMBL20696068 0.75 GRIN2D (0.40) SRD5A1GAAALDH1A1
SCHEMBL18707381 0.72 NOTUM (0.42) HPGDSLC6A2MTNR1AMTNR1BNOTUM
SCHEMBL19954697 0.72 NOTUM (0.42) HPGDSLC6A2MTNR1AMTNR1BNOTUM
SCHEMBL20169239 0.71 SRD5A1 (0.34) SRD5A1
SCHEMBL12609751 0.69 NOTUM (0.37) HPGDSLC6A2MTNR1AMTNR1BNOTUM
SCHEMBL18017365 0.68 SRD5A1 (0.36) SRD5A1NOTUMAADATGOT1KYAT1
SCHEMBL17751517 0.66 ROCK1 (0.37) HPGDSLC6A2MTNR1AMTNR1BNOTUM
SCHEMBL28648154 0.66 NOTUM (0.44) HPGDSLC6A2MTNR1ANOTUMAADAT
SCHEMBL3467602 0.66 NOTUM (0.39) SRD5A1HPGDMEN1KMT2ASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9735378-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-08-15 US disclosed
US-20150069334-A1 IRIDIUM/PLATINUM METAL COMPLEX UNIVERSAL DISPLAY CORPORATION (US) 2015-03-12 US disclosed