SCHEMBL27763448

SCHEMBL27763448

COCCN1CSc2cc(S(C)(=O)=O)ccc21

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ PABPC1 P11940 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ MDM2 Q00987 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ TSHR P16473 2/20 0.32

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
SCHEMBL31462466 0.70 LMNA (0.34) MAPT
Ammonia Solution, Strong SCHEMBL29066661 0.69 ALDH1A1 (0.36) SMN1; SMN2HPGDKDM4EALDH1A1GAA
SCHEMBL5050834 0.69 DRD2 (0.37) BRD4SMN1; SMN2HPGDKDM4EALDH1A1
SCHEMBL30504211 0.68 MAPT (0.32) ALDH1A1MAPT
Ammonia Solution, Strong SCHEMBL29883519 0.68 ALDH1A1 (0.36) SMN1; SMN2HPGDKDM4EALDH1A1GAA
Alcohol SCHEMBL28644544 0.67 ALDH1A1 (0.35) SMN1; SMN2KDM4EALDH1A1GAAHSD17B10
SCHEMBL30388192 0.64 ALDH1A1 (0.40) BRD4HPGDKDM4EALDH1A1GAA
SCHEMBL5050831 0.62 KDM4E (0.53) SMN1; SMN2HPGDKDM4EALDH1A1GAA
SCHEMBL27763450 0.58 MEN1 (0.31) SMN1; SMN2ALDH1A1NPSR1HSD17B10MAPT
SCHEMBL14168754 0.58 PNMT (0.46) SMN1; SMN2

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
CN-101448800-A Novel compounds as cannabinoid receptor ligands and uses thereof ABBOTT LAB (US) 2009-06-03 — — CN disclosed
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