SCHEMBL14650557

SCHEMBL14650557

COCCOCC(C)OCC(C)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(c1ccc(Oc2ccccc2)cc1)C5=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 2/20 0.38
▸ MGLL Q99685 2/20 0.35
▸ KMT2A Q03164 5/20 0.35
▸ PTGES O14684 1/20 0.35
▸ MEN1 O00255 4/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NR1H3 Q13133 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ BRD4 O60885 1/20 0.32
▸ FAAH O00519 1/20 0.32
▸ PLA2G1B P04054 1/20 0.31
▸ ATG4B Q9Y4P1 1/20 0.31
▸ BTK Q06187 1/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL14650542 0.93 ALDH1A1 (0.36) MCHR1KMT2AMEN1LMNAHTT
SCHEMBL14650550 0.92 ALDH1A1 (0.35) MCHR1KMT2AMEN1LMNAHTT
SCHEMBL14650558 0.91 MCHR1 (0.41) MCHR1MGLLKMT2AMEN1NR1H3
SCHEMBL14650593 0.87 POLB (0.32) POLB
SCHEMBL14650653 0.86 MGLL (0.43) MCHR1MGLLKMT2APTGESMEN1
SCHEMBL14650591 0.84 TERT (0.34) —
SCHEMBL14650603 0.84 TERT (0.34) —
SCHEMBL14650554 0.84 CA2 (0.48) —
SCHEMBL14650589 0.84 TERT (0.33) —
SCHEMBL14650605 0.84 TERT (0.33) —

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-9051468-B2 Dyes for polymer coloration, their preparation and their use CLARIANT INTERNATIONAL LTD (CH) 2015-06-09 — — US disclosed
US-20130019415-A1 DYES FOR POLYMER COLORATION, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2013-01-24 — — US disclosed
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