SCHEMBL27100799

SCHEMBL27100799

CC1(C)c2cc(C(=O)c3ccc(F)cc3)ccc2NC12C=Cc1ccccc1O2

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLK2 Q86UE8 2/20 0.33
MAPK1 P28482 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
PTGS1 P23219 1/20 0.32
KDR P35968 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NPC1 O15118 1/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
HIF1A Q16665 2/20 0.30
EPAS1 Q99814 2/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 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
SCHEMBL27100747 0.93 ALDH1A1 (0.34) MAPK1PTGS1KDRNPC1LMNA
SCHEMBL27100750 0.88 MAPT (0.34) TLK2MAPK1NPC1TSHRLMNA
SCHEMBL27100811 0.88 SMN1; SMN2 (0.35) MAPK1NPC1LMNAHTR2CHTR2B
SCHEMBL27100757 0.86 MEN1 (0.37) PTGS1NPC1LMNAGAA
SCHEMBL27100762 0.86 MEN1 (0.33) TLK2MAPK1ADORA3PTGS1KDR
SCHEMBL27100797 0.85 SIRT1 (0.33) MAPK1ADORA3PTGS1KDRRXFP1
SCHEMBL27100761 0.85 MEN1 (0.33) MAPK1ADORA3PTGS1KDRRXFP1
SCHEMBL27100809 0.85 HPGD (0.36) MAPK1PTGS1NPC1TSHRLMNA
SCHEMBL27100755 0.83 ABCC9 (0.32) MAPK1ADORA3PTGS1KDRRXFP1
SCHEMBL27100792 0.82 ALDH1A1 (0.35) PTGS1NPC1LMNAGAA

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-20240066790-A1 Process and apparatus for locally polymerizing a starting material by dual color photopolymerization and method for volumetric printing of a shaped body XOLO GMBH (DE) 2024-02-29 US disclosed