SCHEMBL7795616

SCHEMBL7795616

O=C=Nc1ccccc1-c1ccc(COC2CCCCO2)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 1/20 0.36
SELE P16581 1/20 0.36
KDM4C Q9H3R0 1/20 0.35
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35
CREBBP Q92793 2/20 0.35
EP300 Q09472 1/20 0.35
MGLL Q99685 2/20 0.34
OXTR P30559 2/20 0.34
AVPR1A P37288 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NAAA Q02083 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL7795519 0.79 ICAM1 (0.39) ICAM1SELEKDM4CITGB1ITGA4
SCHEMBL7795558 0.76 ALDH1A1 (0.43) ICAM1SELEKDM4CITGB1ITGA4
SCHEMBL11059345 0.75 GBA1 (0.40) ITGB1ITGA4OXTRAVPR1ANAAA
SCHEMBL4184332 0.75 KDM4C (0.47) ICAM1SELEKDM4CCREBBPEP300
SCHEMBL20658893 0.74 ICAM1 (0.39) ICAM1SELEKDM4CCREBBPEP300
SCHEMBL14650437 0.74 KDM4C (0.39) ICAM1SELEKDM4CITGB1ITGA4
SCHEMBL11258174 0.73 KDM4C (0.46) ICAM1SELEKDM4CCREBBPEP300
SCHEMBL7796030 0.73 ITGB1 (0.43) ITGB1ITGA4CREBBPEP300MEN1
SCHEMBL1732484 0.72 ALDH1A1 (0.46) ICAM1SELEMEN1KMT2A
SCHEMBL16482755 0.72 ICAM1 (0.40) ICAM1SELEKDM4CCREBBPEP300

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 7 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-0659179-A4 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE. MERCK & CO INC (US) 1995-08-09 EP disclosed
EP-0659179-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO. INC. (US) 1995-06-28 EP 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