SCHEMBL38660786

SCHEMBL38660786

O=C(Nc1ccccc1OCc1cnon1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.51
PTK2 Q05397 1/20 0.48
AHR P35869 1/20 0.46
GAA P10253 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
BRD4 O60885 1/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MAPT P10636 2/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
KDM4E B2RXH2 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
SCHEMBL38661985 0.79 BRD4 (0.50) P4HTMPTK2AHRGAANPC1
SCHEMBL38660474 0.79 PTK2 (0.55) P4HTMPTK2AHRGAANPC1
SCHEMBL11549645 0.78 BRD4 (0.70) GAANPC1RAB9ATDP1L3MBTL1
SCHEMBL38660185 0.78 BRD4 (0.70) GAANPC1RAB9ATDP1L3MBTL1
SCHEMBL38660438 0.78 P4HTM (0.46) P4HTMPTK2AHRGAANPC1
SCHEMBL38660968 0.78 POLB (0.52) P4HTMAHRGAANPC1RAB9A
SCHEMBL8970981 0.77 PTK2 (0.70) P4HTMPTK2AHRGAANPC1
SCHEMBL38660891 0.75 MAPT (0.60) RAB9ATDP1L3MBTL1BRD4POLB
SCHEMBL38660615 0.75 AKR1C3 (0.71) ALDH1A1MAPTTSHRNPSR1KDM4E
SCHEMBL12427892 0.74 MAPK1 (0.58) P4HTMPTK2AHRGAANPC1

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