SCHEMBL8577131

SCHEMBL8577131

CCCCc1cccc2c1C(C(=O)N(CC(F)(F)F)n1cnc(NC(=O)c3ccccc3Oc3ccccc3)c1)c1ccccc1-2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ BCL2L2 Q92843 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ AGTR1 P30556 1/20 0.31
▸ AGTR2 P50052 1/20 0.31
▸ PAX8 Q06710 1/20 0.31
▸ MAPK8 P45983 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ AURKA O14965 1/20 0.30

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
SCHEMBL8578880 0.89 TRPV1 (0.32) L3MBTL1RAB9A
SCHEMBL8574668 0.87 GAA (0.36) GAATSHRLMNAMAPTL3MBTL1
SCHEMBL8577127 0.81 LMNA (0.41) GAATSHRLMNAMAPTL3MBTL1
SCHEMBL8573358 0.81 ALDH1A1 (0.39) MAPTL3MBTL1NPSR1ALDH1A1RXFP1
SCHEMBL8717987 0.81 CCR3 (0.44) MAPTMEN1KMT2A
SCHEMBL8665520 0.80 CCR3 (0.42) L3MBTL1NPSR1
SCHEMBL8668024 0.79 CCR3 (0.35) GAATSHRLMNAMAPTL3MBTL1
SCHEMBL8482402 0.79 CCR3 (0.35) GAATSHRLMNAMAPTL3MBTL1
SCHEMBL8712541 0.79 CCR3 (0.44) MAPTL3MBTL1NPSR1MEN1KMT2A
SCHEMBL8665531 0.78 CCR3 (0.41) L3MBTL1NPSR1

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-5760246-A ANTILIPEMIC AGENTS, ANTICHOLESTEROL AGENTS BRISTOL-MYERS SQUIBB COMPANY 1998-06-02 — — US disclosed
US-H1729-H Method for preparing compounds employing solid phase synthesis and novel linker-resin BRISTOL-MYERS SQUIBB COMPANY (US) 1998-05-05 — — US disclosed
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