SCHEMBL23201615

SCHEMBL23201615

CCOc1ncccc1-c1ccccc1C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.52
ALDH1A1 P00352 5/20 0.49
LMNA P02545 2/20 0.47
NPC1 O15118 1/20 0.47
TSHR P16473 1/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPK1 P28482 2/20 0.46
RAB9A P51151 1/20 0.46
CSNK1A1 P48729 1/20 0.46
TYRO3 Q06418 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL23201606 0.86 L3MBTL1 (0.48) L3MBTL1ALDH1A1LMNANPC1TSHR
SCHEMBL31188610 0.86 L3MBTL1 (0.48) L3MBTL1ALDH1A1LMNANPC1TSHR
SCHEMBL4724490 0.86 L3MBTL1 (0.58) L3MBTL1ALDH1A1LMNANPC1TSHR
SCHEMBL23041012 0.78 MAPT (0.53) L3MBTL1ALDH1A1LMNAHPGDKDM4E
Nitric Acid SCHEMBL28953171 0.78 L3MBTL1 (0.56) L3MBTL1ALDH1A1LMNANPC1TSHR
Hydrochloric Acid SCHEMBL1076729 0.78 LMNA (0.42) L3MBTL1ALDH1A1LMNAKDM4EMAPK1
SCHEMBL11546391 0.77 L3MBTL1 (0.60) L3MBTL1ALDH1A1LMNANPC1TSHR
SCHEMBL28531811 0.76 L3MBTL1 (0.49) L3MBTL1ALDH1A1LMNANPC1TSHR
SCHEMBL3729269 0.75 ALDH1A1 (0.55) L3MBTL1ALDH1A1LMNANPC1TSHR
SCHEMBL29786652 0.75 ALDH1A1 (0.55) L3MBTL1ALDH1A1LMNANPC1TSHR

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
EP-3802500-A1 MELANOCORTIN SUBTYPE-2 RECEPTOR (MC2R) ANTAGONISTS AND USES THEREOF Crinetics Pharmaceuticals, Inc. (US) 2021-04-14 EP claimed