SCHEMBL24314186

SCHEMBL24314186

Cc1cc(C(C)(C)C)ccc1OCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
PKM P14618 1/20 0.49
CSF1R P07333 1/20 0.48
TGFBR1 P36897 1/20 0.48
GPR119 Q8TDV5 13/20 0.47
CHEK2 O96017 1/20 0.44

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
SCHEMBL24314185 0.89 KDM4E (0.47) KDM4EPKMCSF1RTGFBR1GPR119
SCHEMBL16688907 0.88 MEN1 (0.50) KDM4EPKMCSF1RGPR119
SCHEMBL19430661 0.87 KDM4E (0.47) KDM4EPKMCSF1RGPR119CHEK2
SCHEMBL24313742 0.86 TGFBR1 (0.49) KDM4EPKMCSF1RTGFBR1GPR119
SCHEMBL24313740 0.86 CHEK2 (0.45) KDM4EPKMCSF1RTGFBR1GPR119
SCHEMBL30988946 0.85 KDM4E (0.55) KDM4EPKMCSF1RTGFBR1GPR119
SCHEMBL24333408 0.84 KDM4E (0.46) KDM4EPKMCSF1RTGFBR1GPR119
SCHEMBL20536605 0.81 MGLL (0.47) KDM4EPKMCSF1RGPR119CHEK2
SCHEMBL16688916 0.81 USP30 (0.50) KDM4EPKMCSF1RGPR119CHEK2
SCHEMBL9014080 0.81 GPR119 (0.50) KDM4EPKMCSF1RTGFBR1GPR119

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
WO-2022081842-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed
WO-2022081807-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed