SCHEMBL23798672

SCHEMBL23798672

CC(=O)C(C)CC(C)C(=O)Oc1ccc(C)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
ELANE P08246 2/20 0.42
GAA P10253 1/20 0.41
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAOB P27338 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL12419169 0.81 LMNA (0.52) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL16906272 0.79 LMNA (0.50) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL28969201 0.78 LMNA (0.48) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL28969199 0.78 LMNA (0.49) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL17882061 0.78 LMNA (0.48) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL23798618 0.77 LMNA (0.57) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL11861904 0.77 ELANE (0.51) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL15965768 0.77 LMNA (0.47) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL13225899 0.76 LMNA (0.59) LMNAELANEGAAALDH1A1KMT2A
SCHEMBL891415 0.76 ELANE (0.68) LMNAELANEGAAALDH1A1KMT2A

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-2021178818-A2 THERAPEUTIC AGENTS AND CONJUGATES THEREOF BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2021-09-10 WO disclosed