SCHEMBL6164736

SCHEMBL6164736

NC(=O)C1CC(NC(=O)[CH]Cc2ccccc2)c2ccccc2S1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.34
ALPI P09923 1/20 0.34
EPHX2 P34913 4/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 3/20 0.32
LMNA P02545 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.31
TEAD1 P28347 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
NPC1 O15118 1/20 0.31

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
SCHEMBL19712313 0.67 EPHX2 (0.40) EPHX2MAPTSMN1; SMN2ALDH1A1LMNA
SCHEMBL4081806 0.66 TSHR (0.38) EPHX2SMN1; SMN2ALDH1A1TSHRNPC1
SCHEMBL2687705 0.64 EPHX2 (0.62) EPHX2SMN1; SMN2ALDH1A1TSHRNPC1
SCHEMBL3345536 0.64 HTT (0.41) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL19712342 0.63 HSD17B10 (0.44) EPHX2SMN1; SMN2ALDH1A1LMNAGAA
SCHEMBL6162053 0.63 LMNA (0.42) ALDH1A1LMNACYP2D6CYP2C19MMP1
SCHEMBL4073041 0.62 ALDH1A1 (0.62) EPHX2SMN1; SMN2ALDH1A1LMNACYP2D6
SCHEMBL19712315 0.62 EPHX2 (0.38) EPHX2MAPTSMN1; SMN2TSHRNPC1
SCHEMBL295277 0.61 MAOB (0.48) ALPISMN1; SMN2LMNACYP2C19
SCHEMBL7749862 0.61 KMT2A (0.46) ALPLMAPTSMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1134213-B1 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER (US) 2005-11-02 EP disclosed
EP-0832065-B1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER (US) 2001-10-10 EP disclosed
EP-1134213-A2 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER INC. (US) 2001-09-19 EP disclosed
US-6277877-B1 GLYCOGEN PHOSPHORYLASE INHIBITOR; ANTIDIABETIC AGENTS PFIZER, INC. 2001-08-21 US disclosed
US-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US disclosed