SCHEMBL6897706

SCHEMBL6897706

Cc1ccc(C2(CN)C3CC4CC(C3)CC2C4)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.62
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAOB P27338 4/20 0.39
MAOA P21397 2/20 0.39
ALDH1A1 P00352 1/20 0.37
NR1I2 O75469 1/20 0.37

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
Hydrochloric Acid SCHEMBL6901794 0.98 HSD11B1 (0.60) HSD11B1MEN1KMT2AMAOBMAOA
Hydrochloric Acid SCHEMBL6683835 0.85 HSD11B1 (0.57) HSD11B1MEN1KMT2AMAOBMAOA
SCHEMBL6897711 0.81 HSD11B1 (0.62) HSD11B1MEN1KMT2AMAOBMAOA
Hydrochloric Acid SCHEMBL6900311 0.81 HSD11B1 (0.60) HSD11B1MEN1KMT2AMAOBMAOA
Hydrochloric Acid SCHEMBL6898309 0.81 HSD11B1 (0.63) HSD11B1MEN1KMT2ANR1I2
SCHEMBL6685193 0.80 HTR2C (0.46) HSD11B1MEN1KMT2A
Hydrochloric Acid SCHEMBL6898935 0.80 HSD11B1 (0.63) HSD11B1MEN1KMT2AMAOBMAOA
Hydrochloric Acid SCHEMBL6894594 0.80 HSD11B1 (0.60) HSD11B1MEN1KMT2AMAOBMAOA
Ammonia Solution, Strong SCHEMBL6683995 0.79 HSD11B1 (0.59) HSD11B1MEN1KMT2AALDH1A1NR1I2
Hydrochloric Acid SCHEMBL6896770 0.79 HTR2C (0.48) HSD11B1MEN1KMT2A

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
EP-1143964-B1 2-ADAMANTANEMETHANAMINE COMPOUNDS FOR TREATING ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION VERNALIS RES LTD (GB) 2004-03-24 EP claimed
US-6531511-B1 N-methyl aspartate receptor antagonist VERNALIS RESEARCH LIMITED (GB) 2003-03-11 US claimed
JP-2002535360-A 2002-10-22 JP claimed
EP-1143964-A1 2-ADAMANTANEMETHANAMINE COMPOUNDS FOR TREATING ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION VERNALIS RESEARCH LIMITED (GB) 2001-10-17 EP claimed
WO-2000044371-A1 2-ADAMANTANEMETHANAMINE COMPOUNDS FOR TREATING ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION VERNALIS RESEARCH LIMITED (GB) 2000-08-03 WO claimed
EP-1143964-B1 2-ADAMANTANEMETHANAMINE COMPOUNDS FOR TREATING ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION VERNALIS RES LTD (GB) 2004-03-24 EP disclosed
US-6531511-B1 N-methyl aspartate receptor antagonist VERNALIS RESEARCH LIMITED (GB) 2003-03-11 US disclosed
EP-1143964-A1 2-ADAMANTANEMETHANAMINE COMPOUNDS FOR TREATING ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION VERNALIS RESEARCH LIMITED (GB) 2001-10-17 EP disclosed
WO-2000044371-A1 2-ADAMANTANEMETHANAMINE COMPOUNDS FOR TREATING ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION VERNALIS RESEARCH LIMITED (GB) 2000-08-03 WO disclosed