SCHEMBL19850174

SCHEMBL19850174

N#Cc1cccc(-c2ccc3c(c2)c2cc(-c4cccc(C#N)c4)ccc2n3-c2cccc3c2C(=O)N(c2cccc(-c4ccccc4)c2)C3O)c1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 1/20 0.36
▸ PTGES O14684 1/20 0.35
▸ PTPN5 P54829 1/20 0.35
▸ MCHR1 Q99705 2/20 0.35
▸ XDH P47989 1/20 0.34
▸ SLC22A12 Q96S37 1/20 0.34
▸ GRIA2 P42262 1/20 0.34
▸ GRIA4 P48058 1/20 0.34
▸ PGR P06401 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CLK4 Q9HAZ1 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ USP30 Q70CQ3 1/20 0.33
▸ TGFBR1 P36897 1/20 0.32
▸ MMP12 P39900 1/20 0.32
▸ MMP13 P45452 1/20 0.32
▸ CHEK1 O14757 1/20 0.32

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
SCHEMBL19850175 0.97 FFAR2 (0.35) FFAR2PTGESPTPN5MCHR1XDH
SCHEMBL19842591 0.94 FASN (0.35) FFAR2PTGESALDH1A1
SCHEMBL19850147 0.93 KMT2A (0.33) FFAR2PTGESALDH1A1
SCHEMBL24282901 0.93 FFAR2 (0.36) FFAR2PTGESPTPN5MCHR1XDH
SCHEMBL23476469 0.92 PGR (0.36) FFAR2PTPN5PGR
SCHEMBL19850086 0.91 COMT (0.35) ALDH1A1
SCHEMBL19843121 0.90 CHEK1 (0.36) FFAR2PTPN5MCHR1XDHSLC22A12
SCHEMBL19843273 0.89 BACE1 (0.35) BACE1
SCHEMBL19850281 0.89 G6PD (0.34) FFAR2PTGESALDH1A1
SCHEMBL19850088 0.88 KMT2A (0.36) ALDH1A1

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
EP-3494112-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-04-20 — — EP disclosed
WO-2018024725-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-08 — — WO disclosed
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