SCHEMBL4020050

SCHEMBL4020050

Cc1ccc(N2CC2C(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.45
S1PR1 P21453 1/20 0.41
S1PR5 Q9H228 1/20 0.41
FFAR1 O14842 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
NOTUM Q6P988 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GFER P55789 1/20 0.38
POLB P06746 1/20 0.38
F2 P00734 1/20 0.38
ELANE P08246 1/20 0.38
CTSG P08311 1/20 0.38
CMA1 P23946 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
SCHEMBL4350992 0.80 NR1H4 (0.42) HTTS1PR1S1PR5SMN1; SMN2ALDH1A1
SCHEMBL29822795 0.74 MAPT (0.37) HTTSMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL29079983 0.74 NPC1 (0.39) HTTSMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL9108668 0.70 KMT2A (0.51) TSHRALDH1A1NPSR1TDP1POLB
SCHEMBL1366894 0.70 ALDH1A1 (0.55) HTTSMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL9108663 0.70 KMT2A (0.51) TSHRALDH1A1NPSR1TDP1POLB
SCHEMBL16784692 0.70 MAPT (0.46) HTTSMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL20027946 0.69 FFAR1 (0.44) FFAR1SMN1; SMN2TSHRMAPK1ALDH1A1
SCHEMBL19801268 0.68 NOTUM (0.73) NOTUM
SCHEMBL18101806 0.68 NOTUM (0.73) NOTUM

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
WO-2009096907-A1 AZIRIDINE SYNTHESIS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-08-06 WO disclosed