SCHEMBL16549008

SCHEMBL16549008

N#Cc1ccc2c(c1)c1cc(-c3ccc(-c4cccc5ccccc45)c4ccccc34)ccc1n2-c1cccc2cccnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP1 P07148 1/20 0.41
▸ HTR1A P08908 1/20 0.40
▸ SLC40A1 Q9NP59 2/20 0.37
▸ AVPR2 P30518 1/20 0.36
▸ AVPR1A P37288 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ PIM1 P11309 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ GLO1 Q04760 2/20 0.34
▸ PKM P14618 1/20 0.34
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34

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
SCHEMBL16549098 0.91 FABP1 (0.41) FABP1HTR1ASLC40A1CYP1A2CYP3A4
SCHEMBL16809578 0.90 FABP1 (0.40) FABP1HTR1ASLC40A1CYP1A2CYP3A4
SCHEMBL16809795 0.89 ABCG2 (0.40) FABP1HTR1ASLC40A1CYP1A2CYP3A4
SCHEMBL16548673 0.85 HTR1A (0.40) FABP1HTR1ASLC40A1CYP1A2CYP3A4
SCHEMBL16549007 0.85 GRM5 (0.42) FABP1PIM1
SCHEMBL16455797 0.84 FABP1 (0.38) FABP1HTR1ASLC40A1MEN1KMT2A
SCHEMBL16809513 0.84 ABCG2 (0.41) FABP1HTR1ACYP1A2CYP3A4HPGD
SCHEMBL16809794 0.83 CA1 (0.36) CYP1A2HPGDCYP2C19PIM1KDM4E
SCHEMBL16809606 0.83 HTR1A (0.40) FABP1HTR1ASLC40A1MEN1KMT2A
SCHEMBL16809533 0.83 ABCG2 (0.41) FABP1HTR1ASLC40A1CYP1A2CYP3A4

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-9716234-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-25 — — US disclosed
US-20150060787-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-05 — — US disclosed
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