SCHEMBL11399153

SCHEMBL11399153

CCCCCCCCCCOC(=O)c1sc(=O)[nH]c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.48
MC4R P32245 1/20 0.48
HTT P42858 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MMP1 P03956 1/20 0.46
MMP9 P14780 1/20 0.46
MMP12 P39900 1/20 0.46
ALDH1A1 P00352 3/20 0.45
TSHR P16473 2/20 0.45
LMNA P02545 1/20 0.45
ESR1 P03372 3/20 0.44
MMP2 P08253 1/20 0.44
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MAPT P10636 1/20 0.42
AKR1C4 P17516 1/20 0.42
AKR1C3 P42330 1/20 0.42

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
SCHEMBL11400579 1.00 GPR84 (0.48) GPR84MC4RHTTSMN1; SMN2MMP1
SCHEMBL11393247 1.00 GPR84 (0.48) GPR84MC4RHTTSMN1; SMN2MMP1
SCHEMBL11395840 1.00 GPR84 (0.48) GPR84MC4RHTTSMN1; SMN2MMP1
SCHEMBL11399329 0.94 MC4R (0.50) GPR84MC4RHTTSMN1; SMN2MMP1
SCHEMBL11399022 0.81 MC4R (0.53) MC4RSMN1; SMN2ALDH1A1TSHRLMNA
SCHEMBL11398706 0.77 MC4R (0.44) MC4RHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL11396158 0.73 MMP1 (0.52) MC4RSMN1; SMN2MMP1MMP9MMP12
SCHEMBL223748 0.73 MAPT (0.55) ALDH1A1TSHRLMNAESR1TP53
SCHEMBL11395537 0.72 RAB9A (0.54) HTTSMN1; SMN2MMP1MMP9MMP12
SCHEMBL11401028 0.72 MAPT (0.45) MC4RSMN1; SMN2ALDH1A1TSHRLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4273573-A Agents for regulating plant growth using 2-thiazolone-5-carboxylic acid compounds BAYER AKTIENGESELLSCHAFT (DE) 1981-06-16 US disclosed
US-3932436-A 2-Thiazolone-5-carboxylic acid ester fungicidal agents BAYER AKTIENGESELLSCHAFT (DT) 1976-01-13 US disclosed