SCHEMBL23640439

SCHEMBL23640439

CC(=O)Nc1cccc(OC2=CC(C)C(C)C=C2)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
GAA P10253 2/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
MTNR1A P48039 2/20 0.45
MTNR1B P49286 2/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 3/20 0.43
CYP1A2 P05177 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TSHR P16473 1/20 0.43
AHR P35869 1/20 0.43
KDR P35968 1/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL24302883 1.00 SMN1; SMN2 (0.46) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL14338249 0.77 MTNR1B (0.69) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL23640233 0.75 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ANPC1MAPK1MTNR1A
SCHEMBL24302885 0.75 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ANPC1MAPK1MTNR1A
SCHEMBL12888865 0.74 MAPK1 (0.65) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL9162294 0.73 MTNR1B (0.77) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL3183886 0.72 ALDH1A1 (0.72) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL14338254 0.72 MTNR1B (0.61) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL14384855 0.72 HSD17B10 (0.72) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL27588285 0.72 ALDH1A1 (0.56) SMN1; SMN2RAB9ANPC1GAAHTT

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-3848367-A1 TRICYCLIC COMPOUNDS ACTING ON CRBN PROTEINS Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-07-14 EP disclosed