SCHEMBL19624672

SCHEMBL19624672

CNN[C@H]1CC[C@@H](N(C)C(=O)OC(C)(C)C)CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
BUB1 O43683 1/20 0.35
BTK Q06187 1/20 0.34
ASGR1 P07306 1/20 0.33
KAT6A Q92794 1/20 0.31
KAT8 Q9H7Z6 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
JAK3 P52333 1/20 0.31
KDM1A O60341 1/20 0.31
MAOB P27338 1/20 0.31
KDM4D Q6B0I6 1/20 0.31
GAA P10253 1/20 0.31
USP30 Q70CQ3 1/20 0.30
EPHX1 P07099 2/20 0.30

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
SCHEMBL7464533 0.87 HSD11B1 (0.40) HSD11B1BUB1BTKASGR1KAT6A
SCHEMBL26667530 0.87 HSD11B1 (0.40) HSD11B1BUB1BTKASGR1KAT6A
Hydrochloric Acid SCHEMBL7419816 0.86 HSD11B1 (0.40) HSD11B1BUB1BTKASGR1KAT6A
Hydrochloric Acid SCHEMBL8184993 0.86 HSD11B1 (0.40) HSD11B1BUB1BTKASGR1KAT6A
SCHEMBL190837 0.85 HSD11B1 (0.47) HSD11B1BUB1ASGR1KAT6AKAT8
SCHEMBL5270126 0.80 HSD11B1 (0.41) HSD11B1BUB1BTKASGR1KAT6A
SCHEMBL28804055 0.80 HSD11B1 (0.44) HSD11B1BUB1ASGR1KAT6AKAT8
SCHEMBL28804053 0.80 HSD11B1 (0.44) HSD11B1BUB1ASGR1KAT6AKAT8
SCHEMBL228179 0.79 HSD11B1 (0.46) HSD11B1BTKASGR1KDM4DGAA
SCHEMBL1344888 0.79 HSD11B1 (0.41) HSD11B1BUB1BTKASGR1KDM4D

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3246317-B1 BTK INHIBITOR HUBEI BIO PHARMACEUTICAL INDUSTRIAL TECH INSTITUTE INC (CN) 2023-02-22 EP disclosed
EP-3246317-A1 BTK INHIBITOR Hubei Bio-Pharmaceutical Industrial Technological Institute Inc. (CN) 2017-11-22 EP disclosed