Sugi Predict

Sugi Predict / Compounds / SCHEMBL7795558

SCHEMBL7795558

SCHEMBL7795558

O=[N+]([O-])c1ccccc1-c1ccc(COC2CCCCO2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ GSK3A P49840 3/20 0.39
▸ GSK3B P49841 3/20 0.39
▸ AURKA O14965 1/20 0.38
▸ PTGES O14684 1/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ APAF1 O14727 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ICAM1 P05362 1/20 0.36
▸ SELE P16581 1/20 0.36
▸ PKM P14618 1/20 0.36

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
SCHEMBL5206947 0.80 IDO1 (0.46) ALDH1A1L3MBTL1MAPTMEN1KMT2A
SCHEMBL7795519 0.80 ICAM1 (0.39) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL3078394 0.77 KMT2A (0.45) ALDH1A1TDP1NPC1RAB9AMAPT
SCHEMBL20985435 0.77 ALDH1A1 (0.38) ALDH1A1TDP1PTGESL3MBTL1MAPT
SCHEMBL11068614 0.76 KDM4E (0.49) ALDH1A1NPC1RAB9AMAPTKMT2A
SCHEMBL7795616 0.76 ICAM1 (0.36) MEN1KMT2AICAM1SELEKDM4C
SCHEMBL11059345 0.76 GBA1 (0.40) ITGB1ITGA4
SCHEMBL4184332 0.76 KDM4C (0.47) MEN1KMT2AICAM1SELEKDM4C
SCHEMBL9798503 0.75 ALDH1A1 (0.34) ALDH1A1NPC1MAPTMEN1KMT2A
SCHEMBL16499726 0.75 ALDH1A1 (0.44) ALDH1A1TDP1NPC1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0659179-B1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 2001-11-21 — — EP disclosed
US-5968924-A HAVE THE ABILITY TO STIMULATE THE RELEASE OF NATURAL OR ENDOGENOUS GROWTH HORMONE; TREATMENT OF OBESITY, OSTEOPOROSIS MERCK & CO., INC. (US) 1999-10-19 — — US disclosed
US-5672596-A ANIMAL GROWTH CONTROLLERS MERCK & CO., INC. (US) 1997-09-30 — — US disclosed
EP-0711287-A4 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO INC (US) 1996-08-28 — — EP disclosed
EP-0711287-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO. INC. (US) 1996-05-15 — — EP disclosed
EP-0659179-A4 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE. MERCK & CO INC (US) 1995-08-09 — — EP disclosed
US-5430144-A E.g, N-(1-((2'-((methoxycarbonyl)amino)(1,1'-biphenyl)-4-yl) methyl)-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-3-yl)-3 ((fur-2-yl)methyl)amino-3-methylbutanamide MERCK & CO., INC. (US) 1995-07-04 — — US disclosed
EP-0659179-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO. INC. (US) 1995-06-28 — — EP disclosed
WO-1995016675-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-06-22 — — WO disclosed
WO-1995003290-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-02-02 — — WO disclosed
WO-1994005634-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-03-17 — — WO disclosed
US-5283241-A Animal growth regulators MERCK & CO., INC. (US) 1994-02-01 — — US disclosed