SCHEMBL2605825

SCHEMBL2605825

CCCc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccc(-c4ccc(N(c5ccc(CO)cc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.43
▸ TSHR P16473 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.42
▸ LPL P06858 1/20 0.42
▸ LIPG Q9Y5X9 1/20 0.42
▸ MKNK1 Q9BUB5 1/20 0.41
▸ MKNK2 Q9HBH9 1/20 0.41
▸ KCNH2 Q12809 1/20 0.40
▸ HSD11B1 P28845 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL14730143 0.91 FFAR1 (0.47) FFAR1TSHRTAAR1MKNK1MKNK2
SCHEMBL14004019 0.91 TAAR1 (0.48) FFAR1MCL1TAAR1LPLLIPG
SCHEMBL11887134 0.91 TAAR1 (0.48) FFAR1MCL1TAAR1LPLLIPG
SCHEMBL14461270 0.90 TAAR1 (0.47) FFAR1MCL1TAAR1LPLLIPG
SCHEMBL11887469 0.90 TAAR1 (0.47) FFAR1MCL1TAAR1LPLLIPG
SCHEMBL12191267 0.89 TSHR (0.52) FFAR1TSHRTAAR1MKNK1MKNK2
SCHEMBL10610530 0.89 TSHR (0.52) FFAR1TSHRTAAR1MKNK1MKNK2
SCHEMBL14025868 0.89 TSHR (0.52) FFAR1TSHRTAAR1MKNK1MKNK2
SCHEMBL2605676 0.89 TSHR (0.52) FFAR1TSHRTAAR1MKNK1MKNK2
SCHEMBL14159062 0.88 TSHR (0.50) FFAR1TSHRTAAR1MKNK1MKNK2

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
EP-1978571-B1 Organic electroluminescent device and display device FUJI XEROX CO LTD (JP) 2012-04-25 — — EP disclosed
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