SCHEMBL6990199

SCHEMBL6990199

O=C(Cl)[C@@H]1CN2CC[C@H]1C2

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 4/20 0.41
▸ CHRM1 P11229 3/20 0.41
▸ CHRM4 P08173 2/20 0.41
▸ CHRM3 P20309 2/20 0.41
▸ CHRNA7 P36544 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ KMT2A Q03164 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
SCHEMBL14078822 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM4CHRM3CHRNA7
SCHEMBL6990202 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM4CHRM3CHRNA7
Hydrochloric Acid SCHEMBL2419739 0.98 CHRM2 (0.40) CHRM2CHRM1CHRM4CHRM3CHRNA7
Hydrochloric Acid SCHEMBL2419742 0.98 CHRM2 (0.40) CHRM2CHRM1CHRM4CHRM3CHRNA7
SCHEMBL6556633 0.89 ALDH1A1 (0.46) CHRM2CHRM1CHRM4CHRM3CHRNA7
SCHEMBL5167294 0.89 ALDH1A1 (0.46) CHRM2CHRM1CHRM4CHRM3CHRNA7
SCHEMBL5108694 0.89 ALDH1A1 (0.46) CHRM2CHRM1CHRM4CHRM3CHRNA7
Hydrochloric Acid SCHEMBL15329263 0.87 ALDH1A1 (0.49) CHRM2CHRM1CHRM4CHRM3CHRNA7
Hydrochloric Acid SCHEMBL5471959 0.87 ALDH1A1 (0.49) CHRM2CHRM1CHRM4CHRM3CHRNA7
Hydrochloric Acid SCHEMBL2491331 0.87 ALDH1A1 (0.49) CHRM2CHRM1CHRM4CHRM3CHRNA7

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-0874809-B1 CARBAMOYLOXY DERIVATIVES OF MUTILINE AND THEIR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 2003-08-27 — — EP disclosed
EP-0934316-B1 AZABICYCLIC CARBAMOYLOXY MUTILIN DERIVATIVES FOR ANTIBACTERIAL USE SMITHKLINE BEECHAM PLC (GB) 2002-10-16 — — EP disclosed
US-6239175-B1 Carbamoyloxy derivatives of mutiline and their use as antibacterials SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-29 — — US disclosed
US-6121281-A Azabicyclic carbamoyloxy mutilin derivatives for antibacterial use SMITHKLINE BEECHAM P.L.C. (GB) 2000-09-19 — — US disclosed
US-6020368-A MICROBIOCIDES HINKS JEREMY DAVID (US) 2000-02-01 — — US disclosed
EP-0934316-A1 AZABICYCLIC CARBAMOYLOXY MUTILIN DERIVATIVES FOR ANTIBACTERIAL USE SMITHKLINE BEECHAM PLC (GB) 1999-08-11 — — EP disclosed
WO-1998005659-A1 AZABICYCLIC CARBAMOYLOXY MUTILIN DERIVATIVES FOR ANTIBACTERIAL USE SMITHKLINE BEECHAM PLC (GB) 1998-02-12 — — WO disclosed
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