SCHEMBL16273135

SCHEMBL16273135

Cc1ccc2sc3c(F)cccc3c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.40
▸ ACHE P22303 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ PIM2 Q9P1W9 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.33
▸ POLB P06746 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL16273134 0.86 MAPT (0.38) IDO1ACHECYP1A2MAPTALDH1A1
SCHEMBL15639371 0.82 CYP1A2 (0.46) IDO1ACHECYP1A2CYP2A6MAPT
SCHEMBL30278835 0.82 CYP1A2 (0.46) IDO1ACHECYP1A2CYP2A6MAPT
SCHEMBL17899830 0.82 MPI (0.40) IDO1MAPTALDH1A1POLBKDM4E
SCHEMBL23606174 0.79 CYP1A2 (0.35) IDO1ACHECYP1A2CYP2A6MAPT
SCHEMBL11710317 0.79 MAPT (0.44) MAPTALDH1A1KDM4EHPGDEGFR
SCHEMBL23280687 0.79 TDP1 (0.40) IDO1CYP1A2CYP2A6MAPTPIM1
SCHEMBL24962714 0.79 ALOX5 (0.42) ACHECYP1A2CYP2A6MAPTALDH1A1
SCHEMBL15497381 0.79 PIM1 (0.40) IDO1CYP1A2CYP2A6MAPTPIM1
SCHEMBL16273161 0.79 KIF11 (0.37) IDO1CYP1A2CYP2A6MAPTPIM1

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
US-20140353646-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2014-12-04 — — US disclosed
US-20140353646-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2014-12-04 — — US disclosed
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