SCHEMBL22259795

SCHEMBL22259795

COc1nc2c(c3ccccc13)CC(C(C)(C)C)CC2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.57
▸ MAPK1 P28482 3/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ NPSR1 Q6W5P4 2/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ TP53 P04637 4/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ TSHR P16473 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.35
▸ ACHE P22303 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ SLC2A1 P11166 1/20 0.33
▸ USP2 O75604 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
SCHEMBL24357492 0.81 MAPT (0.60) MAPTMAPK1MEN1KMT2ANPSR1
SCHEMBL22235378 0.75 MAPT (0.56) MAPTMAPK1MEN1KMT2ANPSR1
SCHEMBL22236262 0.75 TP53 (0.37) MAPTMAPK1MEN1KMT2ANPSR1
SCHEMBL12336195 0.73 ALDH1A1 (0.48) MAPTMAPK1MEN1KMT2ASMN1; SMN2
SCHEMBL7674791 0.73 MAPK1 (0.72) MAPTMAPK1MEN1KMT2ANPSR1
SCHEMBL29992327 0.72 MAPT (0.70) MAPTMAPK1MEN1KMT2ANPSR1
SCHEMBL28606634 0.72 MAPT (0.70) MAPTMAPK1MEN1KMT2ANPSR1
SCHEMBL22236100 0.68 MAPT (0.34) MAPTMAPK1MEN1KMT2ANPSR1
SCHEMBL24357725 0.68 DRD2 (0.35) MAPTMAPK1MEN1KMT2ANPSR1
SCHEMBL22236101 0.68 MAPT (0.34) MAPTMAPK1MEN1KMT2ANPSR1

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-2020150366-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2020-07-23 — — WO disclosed
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