SCHEMBL7669092

SCHEMBL7669092

CC(C)(C)OC(=O)N1CCCSc2cc(C(F)(F)F)ccc21

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
GPR119 Q8TDV5 3/20 0.42
NOTUM Q6P988 1/20 0.41
KDM1A O60341 1/20 0.38
HSD17B3 P37058 1/20 0.38
TACR1 P25103 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
BRD4 O60885 1/20 0.36
STS P08842 1/20 0.36
BCHE P06276 1/20 0.36
SRPK1 Q96SB4 2/20 0.35
KDR P35968 1/20 0.35
SRPK2 P78362 1/20 0.35
SRPK3 Q9UPE1 1/20 0.35
RORC P51449 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
SCHEMBL7382580 0.82 NOTUM (0.44) MAPTNOTUMHSD17B3ALDH1A1MEN1
SCHEMBL6752845 0.81 NOTUM (0.59) MAPTGPR119NOTUMTACR1BRD4
SCHEMBL7669258 0.80 NOTUM (0.57) MAPTGPR119NOTUMTACR1BRD4
SCHEMBL3530939 0.79 NOTUM (0.44) MAPTGPR119NOTUMTACR1ALDH1A1
SCHEMBL7668885 0.77 GPR119 (0.41) MAPTGPR119NOTUMHSD17B3TACR1
SCHEMBL15686279 0.75 KDM1A (0.45) MAPTGPR119NOTUMKDM1AALDH1A1
SCHEMBL15663537 0.75 NOTUM (0.48) MAPTGPR119NOTUMTACR1ALDH1A1
SCHEMBL7668882 0.75 GPR119 (0.41) MAPTGPR119NOTUMHSD17B3TACR1
SCHEMBL18593249 0.73 NOTUM (0.64) MAPTNOTUMKDM1ABCHE
SCHEMBL6754930 0.73 GPR119 (0.42) MAPTGPR119NOTUMKDM1ATACR1

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
US-6369221-B1 Thiazolobenzoheterocycles, preparation and medicines containing same AVENTIS PHARMA S.A. (FR) 2002-04-09 US disclosed