SCHEMBL8623265

SCHEMBL8623265

O=C([CH]Cc1ccccc1)NCc1cccs1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.64
HPGD P15428 8/20 0.57
RAB9A P51151 3/20 0.55
POLB P06746 2/20 0.54
ALDH1A1 P00352 4/20 0.53
MAPT P10636 2/20 0.51
USP2 O75604 1/20 0.51
TSHR P16473 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
NPC1 O15118 1/20 0.51
RECQL P46063 1/20 0.51
ALOX15 P16050 1/20 0.51
KDM4E B2RXH2 1/20 0.49
HTT P42858 1/20 0.49

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
SCHEMBL4073041 0.81 ALDH1A1 (0.62) LMNAHPGDALDH1A1TSHRSMN1; SMN2
SCHEMBL20194478 0.78 POLB (0.64) LMNAHPGDRAB9APOLBALDH1A1
SCHEMBL17667026 0.77 ALDH1A1 (0.62) LMNAHPGDRAB9APOLBALDH1A1
SCHEMBL17667024 0.77 ALDH1A1 (0.62) LMNAHPGDRAB9APOLBALDH1A1
SCHEMBL28226277 0.77 HPGD (0.77) LMNAHPGDRAB9APOLBALDH1A1
SCHEMBL2466017 0.77 HPGD (0.58) LMNAHPGDRAB9APOLBALDH1A1
SCHEMBL6668159 0.76 POLB (0.62) LMNAHPGDRAB9APOLBALDH1A1
SCHEMBL4071827 0.76 ALDH1A1 (0.60) LMNAALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL3561734 0.76 POLB (0.70) LMNAHPGDPOLBALDH1A1MAPT
SCHEMBL7778409 0.75 USP2 (0.69) LMNAHPGDRAB9APOLBALDH1A1

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-0832065-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER INC. (US) 1998-04-01 EP disclosed