SCHEMBL19681865

SCHEMBL19681865

CNc1ccc(Sc2ccc(C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
ALDH1A1 P00352 3/20 0.47
PTGIR P43119 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
HPGD P15428 2/20 0.45
ATM Q13315 1/20 0.45
MLYCD O95822 1/20 0.42
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HKDC1 Q2TB90 1/20 0.39
ALOX12 P18054 1/20 0.39
HAO1 Q9UJM8 1/20 0.38
MAPK1 P28482 1/20 0.38
ACHE P22303 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL11507985 0.90 ALDH1A1 (0.54) MAPTALDH1A1PTGIRL3MBTL1HPGD
SCHEMBL22100714 0.90 L3MBTL1 (0.43) MAPTALDH1A1PTGIRL3MBTL1HPGD
SCHEMBL44533 0.84
SCHEMBL15933122 0.84 PTGIR (0.43) MAPTALDH1A1PTGIRL3MBTL1HPGD
Hydrochloric Acid SCHEMBL2866389 0.82 MAPT (0.50) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL83853 0.82 ACHE (0.57) MAPTALDH1A1PTGIRL3MBTL1HPGD
SCHEMBL11121834 0.82 ACHE (0.57) MAPTALDH1A1PTGIRL3MBTL1HPGD
SCHEMBL12245875 0.82 ACHE (0.57) MAPTALDH1A1PTGIRL3MBTL1HPGD
SCHEMBL6975747 0.81 TSHR (0.59) MAPTALDH1A1PTGIRHPGDMEN1
SCHEMBL19681866 0.80 L3MBTL1 (0.42) MAPTALDH1A1PTGIRL3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3901162-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF AbbVie Inc. (US) 2021-10-27 EP disclosed
WO-2017207776-A1 SYSTEM FOR DISPENSING A COSMETIC PRODUCT L'OREAL (FR) 2017-12-07 WO disclosed