SCHEMBL2838188

SCHEMBL2838188

CN1CCN(C(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c2c(Cl)cccc2Cl)CC1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ TSHR P16473 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ GLA P06280 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ GAA P10253 2/20 0.48
▸ KMT2A Q03164 1/20 0.48

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
SCHEMBL2840401 0.92 MC4R (0.49) L3MBTL1TSHRALDH1A1GLAGAA
SCHEMBL2839986 0.92 MC4R (0.49) L3MBTL1TSHRALDH1A1GLAGAA
SCHEMBL2839988 0.92 MC4R (0.49) L3MBTL1TSHRALDH1A1GLAGAA
SCHEMBL2845608 0.91 MC4R (0.47) L3MBTL1TSHRALDH1A1GLAPOLB
SCHEMBL2847484 0.88 L3MBTL1 (0.59) L3MBTL1TSHRALDH1A1GLAMAPT
SCHEMBL2846692 0.88 L3MBTL1 (0.62) L3MBTL1TSHRALDH1A1GLAGAA
SCHEMBL2843768 0.88 ALDH1A1 (0.62) L3MBTL1TSHRALDH1A1GLAPOLB
SCHEMBL2843771 0.88 ALDH1A1 (0.62) L3MBTL1TSHRALDH1A1GLAPOLB
SCHEMBL2841026 0.88 ALDH1A1 (0.62) L3MBTL1TSHRALDH1A1GLAPOLB
SCHEMBL2843891 0.87 L3MBTL1 (0.50) L3MBTL1TSHRALDH1A1GLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010039911-A1 CALCILYTIC COMPOUNDS GLAXOSMITHKLINE LLC (US) 2010-04-08 — — WO claimed
WO-2010039911-A1 CALCILYTIC COMPOUNDS GLAXOSMITHKLINE LLC (US) 2010-04-08 — — WO disclosed
WO-2010039911-A1 CALCILYTIC COMPOUNDS GLAXOSMITHKLINE LLC (US) 2010-04-08 — — WO disclosed
Send feedback