SCHEMBL19034482

SCHEMBL19034482

CC(C)(C)c1ccc(-c2ccc(C(=O)O)cc2)c2nsnc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 3/20 0.42
▸ RXRB P28702 3/20 0.42
▸ RXRG P48443 1/20 0.42
▸ NR1H4 Q96RI1 3/20 0.42
▸ RARB P10826 5/20 0.39
▸ RARG P13631 5/20 0.39
▸ SRD5A2 P31213 1/20 0.38
▸ HDAC1 Q13547 2/20 0.38
▸ HDAC6 Q9UBN7 2/20 0.38
▸ GAA P10253 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ HDAC7 Q8WUI4 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ HDAC10 Q969S8 1/20 0.37
▸ HDAC11 Q96DB2 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC9 Q9UKV0 1/20 0.37
▸ HDAC5 Q9UQL6 1/20 0.37
▸ CYP2C8 P10632 1/20 0.37

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
SCHEMBL26133042 0.86 TP53 (0.46) SRD5A2HDAC1HDAC6GAAHDAC3
SCHEMBL15943745 0.81 MEN1 (0.43) RXRARXRBNR1H4RARBRARG
SCHEMBL25475487 0.80 KIF11 (0.39) NR1H4AKR1C3AKR1C2
SCHEMBL19033212 0.80 LMNA (0.36) GAA
SCHEMBL19033220 0.79 KMO (0.40) AKR1C3AKR1C2
SCHEMBL14682708 0.78 MAPT (0.32) —
SCHEMBL22245964 0.77 RARA (0.46) RXRARXRBRXRGNR1H4RARB
SCHEMBL19033218 0.77 RBP4 (0.32) RARBRARGRARA
SCHEMBL19034447 0.76 CISD1 (0.45) —
SCHEMBL19034451 0.75 L3MBTL1 (0.38) RXRBGAA

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
US-9691555-B2 Photosensitive porphyrin dyes for dye-sensitized solar cells NATIONAL CHUNG HSING UNIVERSITY (TW) 2017-06-27 — — US disclosed
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