SCHEMBL10841208

SCHEMBL10841208

CC1=CC(C)(C)Nc2c1ccc(C)c2C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.47
▸ KDM4E B2RXH2 7/20 0.47
▸ HPGD P15428 5/20 0.47
▸ HSD17B10 Q99714 4/20 0.47
▸ MAPT P10636 4/20 0.47
▸ TDP1 Q9NUW8 3/20 0.47
▸ LMNA P02545 2/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ MAPK1 P28482 1/20 0.41
▸ PGR P06401 12/20 0.41
▸ GAA P10253 1/20 0.40
▸ AR P10275 3/20 0.40
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ ALOX12 P18054 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
SCHEMBL6650129 0.83 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL10840550 0.81 PGR (0.35) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL5504578 0.81 CES1 (0.46) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL8024917 0.77 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL14144031 0.72 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL10840500 0.70 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL2719064 0.69 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL6657633 0.69 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL26649009 0.69 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL3235003 0.68 PGR (0.40) ALDH1A1KDM4EHPGDHSD17B10MAPT

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-0198264-A2 Carbamoyl imidazoles NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1986-10-22 — — EP disclosed
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