SCHEMBL25878365

SCHEMBL25878365

Cc1ccc2c(c1)Cc1c-2ccc(C)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.42
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 3/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PARP10 Q53GL7 2/20 0.34
PARP11 Q9NR21 1/20 0.34
ACHE P22303 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
PGR P06401 3/20 0.31
PARP1 P09874 1/20 0.31
NPC1 O15118 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL18261221 0.83 METAP1 (0.46) METAP1MAPTMEN1KMT2AALDH1A1
SCHEMBL13107409 0.80 HPGD (0.32) POLBPGRHPGD
SCHEMBL27845467 0.79 METAP1 (0.42) METAP1MAPTMEN1KMT2AALDH1A1
SCHEMBL5684541 0.79 METAP1 (0.42) METAP1MAPTMEN1KMT2AALDH1A1
SCHEMBL28265785 0.79 METAP1 (0.42) METAP1MAPTMEN1KMT2AALDH1A1
SCHEMBL24727268 0.77 PGR (0.50) METAP1MAPTALDH1A1RAB9AKDM4E
SCHEMBL6903249 0.77 METAP1 (0.41) METAP1MAPTMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL3273192 0.77 METAP1 (0.41) METAP1MAPTMEN1KMT2AALDH1A1
SCHEMBL8917219 0.77 METAP1 (0.41) METAP1MAPTMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL28112705 0.77 METAP1 (0.41) METAP1MAPTMEN1KMT2AALDH1A1

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-2023134594-A1 NEGATIVE DIELECTRIC ANISOTROPIC LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIER, AND LIQUID CRYSTAL DISPLAY COMPONENT 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed