SCHEMBL8332373

SCHEMBL8332373

Cc1ccc(-c2ccccc2Oc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PTGS2 P35354 1/20 0.50
HSPB1 P04792 3/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
HTT P42858 1/20 0.44
HPRT1 P00492 1/20 0.44
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FFAR4 Q5NUL3 1/20 0.42
BRD4 O60885 1/20 0.42

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
SCHEMBL8444172 0.88 NCOA1 (0.58) PTGS2HSPB1MEN1KMT2ANCOA1
SCHEMBL8444830 0.85 PTGS2 (0.47) PTGS2HSPB1MEN1KMT2ARXFP1
SCHEMBL9812692 0.85 ADRA2A (0.50) ACHEPTGS2HSPB1MEN1KMT2A
SCHEMBL9087468 0.85 HSPB1 (0.59) HSPB1MEN1KMT2ARXFP1HTT
SCHEMBL27300897 0.84 HTT (0.47) ACHEHSD17B10PTGS2HSPB1MEN1
Water SCHEMBL11780560 0.83 ADRA2A (0.49) ACHEPTGS2HSPB1MEN1KMT2A
SCHEMBL9405534 0.83 ADRA2A (0.47) PTGS2HSPB1MEN1KMT2ARXFP1
SCHEMBL8331117 0.82 HSPB1 (0.44) PTGS2HSPB1MEN1KMT2AADRA2A
SCHEMBL9405535 0.80 TSHR (0.43) PTGS2HSPB1MEN1KMT2AADRA2A
SCHEMBL1096473 0.80 NCOA1 (0.68) PTGS2MEN1KMT2ANCOA1NCOA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-0513974-B1 Novel benzo-fused lactams that promote the release of growth hormone MERCK & CO INC (US) 1996-09-04 EP disclosed
US-5310737-A Benzo-fused lactams that promote the release of growth hormone MERCK & CO., INC. (US) 1994-05-10 US 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
US-5206235-A Animal growth regulators; stimulants MERCK & CO., INC. (US) 1993-04-27 US disclosed
EP-0513974-A1 Novel benzo-fused lactams that promote the release of growth hormone MERCK & CO. INC. (US) 1992-11-19 EP disclosed
WO-1992016524-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1992-10-01 WO disclosed