SCHEMBL1573652

SCHEMBL1573652

O=C(N1CCSCC1)n1nc(O)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.39
RAB9A P51151 2/20 0.39
AKR1C3 P42330 1/20 0.38
FAAH O00519 6/20 0.37
MGLL Q99685 6/20 0.37
KDM4E B2RXH2 1/20 0.36
RORC P51449 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ELANE P08246 2/20 0.35
NPC1 O15118 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DPP4 P27487 1/20 0.35

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
SCHEMBL1573664 0.86 ALDH1A1 (0.41) HPGDFAAHMGLLKDM4EALDH1A1
SCHEMBL1573842 0.80 ACHE (0.47) HPGDRAB9AKDM4EALDH1A1HSD17B10
SCHEMBL1574012 0.79 HSP90AA1 (0.44) RORCALDH1A1ELANESMN1; SMN2
SCHEMBL1574211 0.76 NOTUM (0.50) HPGDRAB9AAKR1C3KDM4EALDH1A1
SCHEMBL1573776 0.74 ELANE (0.39) RAB9AFAAHMGLLKDM4ERORC
SCHEMBL6015477 0.74 LMNA (0.32) HPGDRAB9AALDH1A1
SCHEMBL11009351 0.71 ELANE (0.64) HPGDRORCELANE
SCHEMBL1574092 0.69 SMN1; SMN2 (0.55) HPGDALDH1A1SMN1; SMN2
SCHEMBL26717871 0.69 RBP4 (0.57) HPGDRAB9AKDM4EALDH1A1HSD17B10
SCHEMBL1573967 0.67 ACHE (0.44) HPGDRAB9AKDM4EALDH1A1ELANE

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-1713779-B1 INDAZOLE DERIVATIVES AS INHIBITORS OF HORMONE-SENSITIVE LIPASES SANOFI AVENTIS DEUTSCHLAND (DE) 2011-04-13 EP disclosed