SCHEMBL30420567

SCHEMBL30420567

NC(=O)c1c(F)cnn1CCCOC1CCCCO1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.38
KDM4C Q9H3R0 1/20 0.36
P2RX3 P56373 8/20 0.35
ICAM1 P05362 1/20 0.35
SELE P16581 1/20 0.35
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PLK1 P53350 1/20 0.33
MET P08581 1/20 0.33
POLB P06746 1/20 0.31

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
SCHEMBL24103542 0.90 MEN1 (0.49) MEN1KMT2AL3MBTL1KDM4CP2RX3
SCHEMBL30420188 0.79 MEN1 (0.48) MEN1KMT2AL3MBTL1KDM4CP2RX3
SCHEMBL24103862 0.73 MEN1 (0.55) MEN1KMT2AL3MBTL1KDM4CP2RX3
SCHEMBL24103333 0.71 L3MBTL1 (0.45) MEN1KMT2AL3MBTL1KDM4CP2RX3
SCHEMBL30419647 0.71 TGFBR1 (0.32)
SCHEMBL24103840 0.69 KMT2A (0.45) MEN1KMT2AKDM4CP2RX3NPC1
SCHEMBL15914347 0.69 KMT2A (0.53) MEN1KMT2AL3MBTL1KDM4CICAM1
SCHEMBL20764819 0.69 MEN1 (0.53) MEN1KMT2AL3MBTL1KDM4CICAM1
SCHEMBL9788 0.69 MEN1 (0.53) MEN1KMT2AL3MBTL1KDM4CICAM1
SCHEMBL15243991 0.69 MEN1 (0.41) MEN1KMT2AL3MBTL1KDM4CP2RX3

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-116209664-A Small molecule modulators of IL-17 利奥制药有限公司 2023-06-02 CN disclosed