SCHEMBL11225833

SCHEMBL11225833

CC1(C)CCc2nc(NC(=O)C(=O)OCc3ccccc3)sc2C1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.41
RAB9A P51151 6/20 0.41
SMN1; SMN2 Q16637 6/20 0.41
NPC1 O15118 5/20 0.41
MAPT P10636 5/20 0.41
GAA P10253 4/20 0.41
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPK1 P28482 1/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.40
LMNA P02545 3/20 0.40
SLC12A2 P55011 1/20 0.40
SLC12A5 Q9H2X9 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
THRB P10828 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL6033285 0.75 GABRP (0.49) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL29209595 0.69 SMN1; SMN2 (0.50) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL2711407 0.69 SMN1; SMN2 (0.50) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL6031607 0.67 MAPT (0.52) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL22581437 0.65 TDP1 (0.45) ALDH1A1RAB9AMAPTKMT2AMAPK1
SCHEMBL20143373 0.65 ALDH1A1 (0.62) ALDH1A1RAB9AMAPTGAAKMT2A
SCHEMBL11348732 0.64 MAPT (0.53) ALDH1A1RAB9AMAPTGAAKDM4E
SCHEMBL11352288 0.64 ELOVL1 (0.46) ALDH1A1RAB9AMAPTKMT2AMAPK1
SCHEMBL9363349 0.62 POLB (0.73) ALDH1A1RAB9AGAAKMT2AMAPK1
SCHEMBL22581315 0.62 TDP1 (0.41) ALDH1A1RAB9AMAPTGAAKDM4E

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-4321372-A Antiulcer thiazol-2-ylcarbamoyl-carboxylic acids, esters and amides PFIZER INC. (US) 1982-03-23 US disclosed