SCHEMBL27100809

SCHEMBL27100809

CC1(C)c2cc(C(=O)c3ccccc3)ccc2NC12C=Cc1cc(F)c(F)cc1O2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.36
NPC1 O15118 3/20 0.36
ALOX15 P16050 2/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TP53 P04637 1/20 0.36
PDK2 Q15119 1/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
AKR1C1 Q04828 1/20 0.32
ACHE P22303 1/20 0.32
ALOX5 P09917 1/20 0.31
PTGS1 P23219 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
SCHEMBL27100757 0.90 MEN1 (0.37) HPGDNPC1ALOX15RAB9ASMN1; SMN2
SCHEMBL27100747 0.88 ALDH1A1 (0.34) HPGDNPC1MAPK1RAB9ASMN1; SMN2
SCHEMBL27100792 0.85 ALDH1A1 (0.35) HPGDNPC1ALOX15RAB9ASMN1; SMN2
SCHEMBL27100753 0.85 ALDH1A1 (0.33) NPC1ALOX15MAPK1RAB9ATP53
SCHEMBL27100801 0.85 MAOB (0.37) HPGDNPC1RAB9ASMN1; SMN2PDK2
SCHEMBL27100799 0.85 TLK2 (0.33) NPC1TSHRMAPK1LMNAPTGS1
SCHEMBL27100790 0.83 SMN1; SMN2 (0.42) HPGDNPC1TSHRMAPK1RAB9A
SCHEMBL27100787 0.83 HTR2C (0.39) HPGDNPC1TSHRMAPK1RAB9A
SCHEMBL27100763 0.83 MEN1 (0.37) HPGDNPC1ALOX15RAB9ASMN1; SMN2
SCHEMBL27100783 0.83 RAB9A (0.36) HPGDNPC1MAPK1RAB9ASMN1; SMN2

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