SCHEMBL6981293

SCHEMBL6981293

COC(=O)Nc1ccc(C(=O)Nc2nc(C(=O)NCCN(C(C)C)C(C)C)cs2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.61
SMN1; SMN2 Q16637 5/20 0.44
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
HPGD P15428 3/20 0.44
GLA P06280 1/20 0.43
MAPT P10636 5/20 0.43
MAPK1 P28482 4/20 0.43
RAB9A P51151 2/20 0.43
HSP90AA1 P07900 1/20 0.43
NPC1 O15118 1/20 0.43
MAPKAPK2 P49137 2/20 0.41
MAP2K1 Q02750 1/20 0.41
HSD17B10 Q99714 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MCHR1 Q99705 1/20 0.40
HTT P42858 1/20 0.40
USP2 O75604 1/20 0.40
TSHR P16473 1/20 0.40

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
Hydrochloric Acid SCHEMBL8155541 0.99 ACHE (0.61) ACHESMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL6962578 0.90 ACHE (0.58) ACHESMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL6983031 0.89 ACHE (0.64) ACHESMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL6984091 0.89 ACHE (0.60) ACHESMN1; SMN2KDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL8150680 0.88 ACHE (0.58) ACHESMN1; SMN2KDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL8147530 0.88 ACHE (0.60) ACHESMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL6976891 0.87 ACHE (0.61) ACHESMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL6977695 0.86 ACHE (0.56) ACHESMN1; SMN2KDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL8150216 0.86 ACHE (0.61) ACHESMN1; SMN2KDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL6973524 0.85 ACHE (0.60) ACHESMN1; SMN2KDM4EALDH1A1LMNA

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-0934938-B1 SUBSTITUTED BENZOYLAMINOTHIAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME ZERIA PHARM CO LTD (JP) 2003-01-15 EP disclosed