SCHEMBL6986660

SCHEMBL6986660

CC(C)(C)OC(=O)CCN1CCC(C(=O)O)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
HSD17B10 Q99714 1/20 0.44
LMNA P02545 1/20 0.41
LTA4H P09960 2/20 0.39
KCNA3 P22001 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
CNR1 P21554 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
HPGD P15428 1/20 0.37
BTK Q06187 1/20 0.37
TP53 P04637 1/20 0.37
KMT2A Q03164 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 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
SCHEMBL5701008 0.84 HSD17B10 (0.46) SMN1; SMN2HSD17B10LMNAHPGDBTK
SCHEMBL6991991 0.82 SLC6A1 (0.49) TP53KMT2A
SCHEMBL16012677 0.82 SLC6A1 (0.49) TP53KMT2A
SCHEMBL18716950 0.81 SMN1; SMN2 (0.44) SMN1; SMN2KCNA3ALDH1A1TSHRCNR1
SCHEMBL17963509 0.81 SMN1; SMN2 (0.44) SMN1; SMN2LTA4HKCNA3ALDH1A1TSHR
SCHEMBL7419075 0.80 SMN1; SMN2 (0.43) SMN1; SMN2KCNA3ALDH1A1TSHRCNR1
SCHEMBL12813597 0.80 SMN1; SMN2 (0.43) SMN1; SMN2KCNA3ALDH1A1TSHRCNR1
SCHEMBL12014400 0.80 ALDH1A1 (0.48) SMN1; SMN2HSD17B10LMNAALDH1A1TSHR
SCHEMBL7010720 0.79 SMN1; SMN2 (0.53) SMN1; SMN2HSD17B10LMNALTA4HALDH1A1
SCHEMBL26088570 0.79 SMN1; SMN2 (0.39) SMN1; SMN2KCNA3ALDH1A1TSHRCNR1

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
WO-2022272133-A2 PROTEIN STABILIZING COMPOUNDS CONTAINING USP7 LIGANDS Stablix, Inc. (US) 2022-12-29 WO disclosed
EP-0730454-A4 ANTIARRHYTHMIC BENZODIAZEPINES MERCK & CO INC (US) 2003-06-04 EP disclosed
EP-0907644-A4 PHARMACEUTICAL PREPARATION MERCK & CO INC (US) 2003-02-05 EP disclosed
EP-0907644-A1 PHARMACEUTICAL PREPARATION Merck & Co., Inc. (US) 1999-04-14 EP disclosed
US-5817658-A ADMINISTERING A DIAZEPINE COMPOUND; DISEASES OF THE EAR MERCK & COMPANY, INC. (US) 1998-10-06 US disclosed
US-5776930-A CARDIOVASCULAR DISORDERS MERCK & COMPANY, INC. (US) 1998-07-07 US disclosed
WO-1998000405-A1 PHARMACEUTICAL PREPARATION MERCK & CO., INC. (US) 1998-01-08 WO disclosed
WO-1997049690-A1 A METHOD FOR TREATING MENIERE'S DISEASE MERCK & CO., INC. (US) 1997-12-31 WO disclosed
US-5595990-A TREATMENT OF CARDIOVASCULAR DISORDERS MERCK & CO., INC. (US) 1997-01-21 US disclosed
EP-0730454-A1 ANTIARRHYTHMIC BENZODIAZEPINES MERCK & CO. INC. (US) 1996-09-11 EP disclosed
US-5426185-A Antiarrhythmia agents having reduced side effects MERCK & CO., INC. (US) 1995-06-20 US disclosed
WO-1995014471-A1 ANTIARRHYTHMIC BENZODIAZEPINES MERCK & CO., INC. (US) 1995-06-01 WO disclosed