SCHEMBL30537720

SCHEMBL30537720

Cc1ccc(C2=CCC(=O)O2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAOB P27338 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
F2 P00734 1/20 0.34
ELANE P08246 1/20 0.34
CTSG P08311 1/20 0.34
CMA1 P23946 1/20 0.34
CTRC Q99895 1/20 0.34
NOTUM Q6P988 1/20 0.34
PTGS1 P23219 1/20 0.34
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33

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
SCHEMBL7255969 0.80 CTRC (0.39) MAPTHPGDHSD17B10CTRCPTGS1
SCHEMBL21946058 0.79 HPGD (0.33) MAPTHPGDHSD17B10ALDH1A1KMT2A
SCHEMBL982857 0.79 SMN1; SMN2 (0.39) MAPTHPGDHSD17B10CTRCALDH1A1
SCHEMBL6137177 0.74 GAA (0.43) MAPTHSD17B10MAOBNOTUMALDH1A1
SCHEMBL782717 0.68
SCHEMBL31589994 0.67 GABRP (0.42) MAOBALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL31590161 0.67 GABRP (0.42) NOTUMNPC1RAB9ASMN1; SMN2MGLL
Ethane SCHEMBL11464231 0.66
SCHEMBL10425527 0.63 ACHE (0.47) HPGDCYP2D6CYP2C9ALOX15CYP2C19
SCHEMBL10448205 0.63 NPC1 (0.45) HPGDCYP2D6CYP2C9ALOX15CYP2C19

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
CN-116606268-A Furan compound synthesized by catalyzing small cyclophosphates and method 三峡大学 2023-08-18 CN disclosed