SCHEMBL14899745

SCHEMBL14899745

CC(C)SN1CCN(c2cnn(-c3cccc(N)c3)c(=O)c2OC2CCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 6/20 0.40
▸ NPBWR1 P48145 5/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ POLB P06746 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ ACACB O00763 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ DCTPP1 Q9H773 2/20 0.33
▸ ADRA2C P18825 1/20 0.33
▸ GRM7 Q14831 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ NCOA2 Q15596 1/20 0.33
▸ NCOA1 Q15788 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33

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
SCHEMBL11944565 0.86 ALDH1A1 (0.40) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL17058044 0.84 MCHR1 (0.39) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL17058354 0.84 MCHR1 (0.38) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL17058290 0.83 MCHR1 (0.41) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL14899793 0.83 MCHR1 (0.43) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL17058463 0.80 POLB (0.39) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL17058486 0.79 MAPT (0.42) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL14899789 0.79 MCHR1 (0.36) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL17057929 0.79 POLB (0.42) MCHR1NPBWR1SMN1; SMN2POLBLMNA
SCHEMBL14899744 0.79 SMN1; SMN2 (0.47) MCHR1NPBWR1SMN1; SMN2POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2586778-A2 Pyridazinone derivatives useful as glucan synthase inhibitors Merck Sharp & Dohme Corp. (US) 2013-05-01 — — EP disclosed
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