SCHEMBL38660966

SCHEMBL38660966

COc1cccc(COc2ccccc2NC(=O)c2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
ABCB1 P08183 1/20 0.60
RAB9A P51151 5/20 0.59
NPC1 O15118 4/20 0.59
NLRP3 Q96P20 1/20 0.59
KDM4E B2RXH2 3/20 0.58
ALDH1A1 P00352 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.57
HPGD P15428 1/20 0.57
PYGM P11217 1/20 0.55
BRD4 O60885 1/20 0.55
MRGPRX4 Q96LA9 2/20 0.55
TOP2A P11388 1/20 0.55
CASP3 P42574 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
LRRK2 Q5S007 1/20 0.53

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
SCHEMBL1123360 0.93 KDM4E (0.62) MEN1KMT2AABCB1RAB9ANPC1
SCHEMBL38659760 0.89 MEN1 (0.62) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL38660185 0.85 BRD4 (0.70) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL11549645 0.85 BRD4 (0.70) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL38660787 0.83 KDM4E (0.59) MEN1KMT2ARAB9ANPC1KDM4E
Hydrochloric Acid SCHEMBL6771662 0.83 KDM4E (0.56) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL38660825 0.82 BRD4 (0.61) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL6542333 0.82 KDM4E (0.57) MEN1KMT2ARAB9ANPC1KDM4E
SCHEMBL38661589 0.81 MEN1 (0.66) MEN1KMT2ARAB9AKDM4EALDH1A1
SCHEMBL1123418 0.81 NR1H4 (0.65) MEN1KMT2ARAB9ANPC1KDM4E

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-122036638-A AKR1C3 inhibitor with tricyclic structure and application thereof 中国药科大学 2026-05-15 CN disclosed