SCHEMBL7802748

SCHEMBL7802748

Nc1ccc2c(c1)Cc1c[c]ccc1-2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.56
▸ MAPT P10636 4/20 0.56
▸ LMNA P02545 3/20 0.56
▸ NPC1 O15118 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ HPGD P15428 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ MEN1 O00255 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ TLR9 Q9NR96 1/20 0.47
▸ CASP1 P29466 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ GAA P10253 2/20 0.37
▸ PARP1 P09874 1/20 0.36
▸ BLM P54132 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL2238415 0.82 NPC1 (0.32) RAB9AMAPTLMNANPC1KDM4E
SCHEMBL71211 0.82 — —
SCHEMBL123584 0.82 RAB9A (0.78) RAB9AMAPTLMNANPC1KDM4E
SCHEMBL29372630 0.82 RAB9A (0.78) RAB9AMAPTLMNANPC1KDM4E
Hydrochloric Acid SCHEMBL11672960 0.80 RAB9A (0.75) RAB9AMAPTLMNANPC1KDM4E
Hydrochloric Acid SCHEMBL30705049 0.80 RAB9A (0.75) RAB9AMAPTLMNANPC1KDM4E
Ammonia Solution, Strong SCHEMBL3418096 0.80 RAB9A (0.75) RAB9AMAPTLMNANPC1KDM4E
Hydrochloric Acid SCHEMBL867181 0.80 RAB9A (0.75) RAB9AMAPTLMNANPC1KDM4E
Hydrochloric Acid SCHEMBL17417855 0.80 RAB9A (0.75) RAB9AMAPTLMNANPC1KDM4E
SCHEMBL2765317 0.78 METAP1 (0.43) —

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0599886-B1 MACROMONOMERS HAVING REACTIVE END GROUPS MISSISSIPPI POLYMER TECH INC (US) 2001-03-21 — — EP disclosed
US-5973075-A POLYPHENYL RESINS MAXDEM INCORPORATION (US) 1999-10-26 — — US disclosed
US-5827927-A Macromonomers having reactive end groups MAXDEM INCORPORATED (US) 1998-10-27 — — US disclosed
US-5824744-A RIGID POLYMER RODS AND MACROMONOMERS WITH REACTIVE END GROUPS FOR REINFORCEMENT MAXDEM INCORPORATED (US) 1998-10-20 — — US disclosed
US-5670564-A Macromonomers having reactive end groups MAXDEM INCORPORATED (US) 1997-09-23 — — US disclosed
EP-0599886-A4 MACROMONOMERS HAVING REACTIVE END GROUPS. MAXDEM INC (US) 1996-07-24 — — EP disclosed
EP-0599886-A1 MACROMONOMERS HAVING REACTIVE END GROUPS MAXDEM INCORPORATED (US) 1994-06-08 — — EP disclosed
WO-1993004099-A1 MACROMONOMERS HAVING REACTIVE END GROUPS MAXDEM INCORPORATED (US) 1993-03-04 — — WO disclosed
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