SCHEMBL25870674

SCHEMBL25870674

CN1C(=O)C(=Cc2ccc(N(c3ccccc3)c3cccc4ccccc34)[se]2)C(=O)N(C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.38
MEN1 O00255 9/20 0.38
MAPT P10636 8/20 0.36
ALDH1A1 P00352 6/20 0.36
USP2 O75604 1/20 0.35
RAB9A P51151 1/20 0.34
GAA P10253 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
POLB P06746 2/20 0.33
DHFR P00374 1/20 0.33
XDH P47989 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
KDM4E B2RXH2 2/20 0.32
TSHR P16473 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL18863392 0.93 MAPT (0.33) KMT2AMEN1MAPTALDH1A1RAB9A
SCHEMBL18863388 0.92 KDM4E (0.31) KMT2AMEN1ALDH1A1KDM4ETSHR
SCHEMBL28705799 0.87 KDM4E (0.31) ALDH1A1KDM4ETSHRSIGMAR1
SCHEMBL28932832 0.87 ALDH1A1 (0.31) MAPTALDH1A1GAAHSD17B10KDM4E
SCHEMBL25870678 0.86 MAPT (0.40) KMT2AMEN1MAPTALDH1A1USP2
SCHEMBL25870682 0.86 NOX4 (0.32) KMT2AMEN1MAPTALDH1A1RAB9A
SCHEMBL25870726 0.86 LMNA (0.34) KMT2AMEN1MAPTRAB9AGAA
SCHEMBL17765782 0.86 KDM4E (0.34) KMT2AMEN1MAPTALDH1A1USP2
SCHEMBL17765779 0.86 KDM4E (0.34) KMT2AMEN1MAPTALDH1A1USP2
SCHEMBL25870705 0.85 MAPT (0.32) KMT2AMEN1MAPTALDH1A1RAB9A

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
US-11711930-B2 2023-07-25 US disclosed