SCHEMBL8600513

SCHEMBL8600513

C=Cc1nccc2c1[nH]c1ccccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 9/20 0.66
KDM4E B2RXH2 7/20 0.66
MAPT P10636 7/20 0.66
MEN1 O00255 5/20 0.66
KMT2A Q03164 5/20 0.66
NPC1 O15118 4/20 0.66
L3MBTL1 Q9Y468 3/20 0.66
RAB9A P51151 2/20 0.66
ATM Q13315 2/20 0.66
MAPK1 P28482 2/20 0.66
NPSR1 Q6W5P4 2/20 0.66
ALDH1A1 P00352 6/20 0.59
GAA P10253 4/20 0.59
POLB P06746 3/20 0.59
S1PR4 O95977 1/20 0.59
LMNA P02545 1/20 0.59
S1PR1 P21453 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
TDO2 P48775 5/20 0.58

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
SCHEMBL3621970 0.83 GLA (0.66) GLAKDM4EMAPTMEN1KMT2A
Water SCHEMBL27633216 0.82 GLA (0.64) GLAKDM4EMAPTMEN1KMT2A
SCHEMBL27899790 0.80 GLA (1.00) GLAKDM4EMAPTMEN1KMT2A
SCHEMBL29381196 0.80 GLA (0.61) GLAKDM4EMAPTMEN1KMT2A
SCHEMBL29078249 0.78 BCHE (0.57) GLAKDM4EMAPTMEN1KMT2A
SCHEMBL30518029 0.78 GLA (0.51) GLAKDM4EMAPTMEN1KMT2A
SCHEMBL30518151 0.78 BCHE (0.57) GLAKDM4EMAPTMEN1KMT2A
SCHEMBL29078166 0.78 GLA (0.51) GLAKDM4EMAPTMEN1KMT2A
SCHEMBL27891345 0.77 TDO2 (0.64) GLAKDM4EMAPTMEN1KMT2A
SCHEMBL27817460 0.77 TDO2 (0.80) KDM4EMAPTMEN1KMT2AMAPK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121108135-A Cyclopropane fused 5H-indolo [3,2,1-ij ] [1,5] naphthyridine derivative and synthetic method and application thereof 成都大学 2025-12-12 CN disclosed
CN-116535403-B Beta-carbopol derivative and preparation method, pharmaceutical composition and application thereof 沈阳药科大学 2024-12-03 CN disclosed
CN-116535403-A Beta-carbopol derivative and preparation method, pharmaceutical composition and application thereof 沈阳药科大学 2023-08-04 CN disclosed
WO-1998000750-A1 PROCESS FOR PRODUCING LIQUID CRYSTAL ALIGNMENT LAYER AND LIQUID CRYSTAL DISPLAY DEVICE WITH THE USE OF THE SAME HOECHST RESEARCH & TECHNOLOGY DEUTSCHLAND GMBH & CO. KG (DE) 1998-01-08 WO disclosed