SCHEMBL26147165

SCHEMBL26147165

CC1=NCCC(Nc2ccc3[nH]c(-c4ccc(Nc5cc(C)nc6ccc(N7CC(C)CC(C)C7)cc56)cn4)nc3c2)=C1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.32
▸ DNMT1 P26358 1/20 0.32
▸ RAD52 P43351 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ADRA2A P08913 1/20 0.31
▸ ADRA2B P18089 1/20 0.31
▸ ADRA2C P18825 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL23999550 0.78 SYK (0.39) MAPTPOLBTSHRMAPK1KMT2A
SCHEMBL30180668 0.78 SYK (0.39) MAPTPOLBTSHRMAPK1KMT2A
SCHEMBL24003990 0.78 MAPT (0.35) MAPTDNMT1RAD52POLBTSHR
SCHEMBL24003973 0.78 MAPT (0.35) MAPTDNMT1RAD52POLBTSHR
SCHEMBL23999351 0.78 MAPT (0.35) MAPTDNMT1RAD52POLBTSHR
SCHEMBL26323174 0.76 MAPT (0.36) MAPTPOLBTSHRMAPK1KMT2A
SCHEMBL26323315 0.75 CBFB (0.34) POLBSMN1; SMN2HSD17B10
SCHEMBL24003965 0.74 PDPK1 (0.41) MAPTPOLBTSHRMAPK1KMT2A
SCHEMBL30180421 0.74 PDPK1 (0.41) MAPTPOLBTSHRMAPK1KMT2A
SCHEMBL23999947 0.74 PDPK1 (0.41) MAPTPOLBTSHRMAPK1KMT2A

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
WO-2023081854-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 — — WO disclosed
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