SCHEMBL23062845

SCHEMBL23062845

COc1nc2ccc(Br)cc2n1C1(C)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 3/20 0.40
NPM1 P06748 2/20 0.40
ALK Q9UM73 2/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
ACACB O00763 2/20 0.36
GLP1R P43220 1/20 0.34
PDE2A O00408 1/20 0.33
PDE10A Q9Y233 1/20 0.33
PRNP P04156 1/20 0.33
FABP4 P15090 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL23042321 0.83 CYP11B1 (0.38) MEN1KMT2AMAPTCYP11B1CYP11B2
SCHEMBL29612462 0.82 NPM1 (0.38) MEN1KMT2AALDH1A1RAB9ANPM1
SCHEMBL23042404 0.82 NPM1 (0.38) MEN1KMT2AALDH1A1RAB9ANPM1
SCHEMBL30838359 0.79 KDM4E (0.40) ALDH1A1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL24668140 0.77 SNCA (0.41) CYP11B1CYP11B2
SCHEMBL15112680 0.75 MAPT (0.55) MEN1KMT2AALDH1A1RAB9ANPM1
SCHEMBL29729492 0.75 MAPT (0.55) MEN1KMT2AALDH1A1RAB9ANPM1
SCHEMBL20987182 0.75 MAPT (0.42) MEN1KMT2AALDH1A1RAB9ANPM1
SCHEMBL29729386 0.75 MAPT (0.42) MEN1KMT2AALDH1A1RAB9ANPM1
SCHEMBL23042350 0.72 CYP11B2 (0.43) MEN1KMT2AALDH1A1RAB9ANPM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4301357-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS Terns Pharmaceuticals, Inc. (US) 2024-01-10 EP disclosed
WO-2022187403-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS TERNS PHARMACEUTICALS, INC. (US) 2022-09-09 WO disclosed
WO-2022187403-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS TERNS PHARMACEUTICALS, INC. (US) 2022-09-09 WO disclosed
EP-4017875-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS Terns Pharmaceuticals, Inc. (US) 2022-06-29 EP disclosed
WO-2021041237-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS Terns, Inc. (US) 2021-03-04 WO disclosed