SCHEMBL28512371

SCHEMBL28512371

COC(=O)CN1CCC(C(=O)c2ccc(OC)cc2)CC1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.70
SMN1; SMN2 Q16637 3/20 0.70
TSHR P16473 1/20 0.70
POLB P06746 2/20 0.69
TDP1 Q9NUW8 1/20 0.69
KMT2A Q03164 3/20 0.60
MAPT P10636 1/20 0.59
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
ALDH1A1 P00352 3/20 0.57
MEN1 O00255 1/20 0.57
HSD11B1 P28845 1/20 0.56
MGLL Q99685 1/20 0.56
SLC18A3 Q16572 2/20 0.56
TNKS O95271 1/20 0.55
TNKS2 Q9H2K2 1/20 0.55
GAA P10253 1/20 0.55
KDM2B Q8NHM5 2/20 0.54

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
SCHEMBL14638146 0.88 POLB (0.65) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL14637558 0.88 LMNA (0.68) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL18730260 0.85 POLB (0.68) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL6202951 0.82 LMNA (0.68) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL24340171 0.81 POLB (0.63) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL5947301 0.81 DRD2 (0.61) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL9227281 0.80 KCNH2 (0.64) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL7247553 0.80 POLB (0.61) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL11103861 0.80 POLB (0.73) LMNASMN1; SMN2TSHRPOLBTDP1
SCHEMBL8103874 0.80 LMNA (0.53) LMNASMN1; SMN2TSHRPOLBTDP1

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-107226807-B Tankyrase inhibitors 北京四环制药有限公司 2021-01-01 CN disclosed