SCHEMBL14799808

SCHEMBL14799808

CN(C)/N=C(C(=N/N(C)C)/c1ccccc1)\c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HSP90AA1 P07900 1/20 0.43
▸ HPGD P15428 2/20 0.41
▸ GFER P55789 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ G6PC1 P35575 1/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ ATM Q13315 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ CES2 O00748 2/20 0.36
▸ CES1 P23141 2/20 0.36
▸ DAO P14920 1/20 0.36
▸ TSHR P16473 1/20 0.36

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
SCHEMBL14799810 1.00 ALDH1A1 (0.44) ALDH1A1MAPTHSP90AA1HPGDGFER
SCHEMBL15439271 0.85 CES2 (0.50) MAPTHPGDGAACYP2C19RAB9A
SCHEMBL15439968 0.85 CES2 (0.48) ALDH1A1MAPTHPGDGAACYP2C19
SCHEMBL15439969 0.85 CES2 (0.48) ALDH1A1MAPTHPGDGAACYP2C19
SCHEMBL15439272 0.85 CES2 (0.50) MAPTHPGDGAACYP2C19RAB9A
SCHEMBL10498731 0.80 ALDH1A1 (0.50) ALDH1A1MAPTHSP90AA1HPGDGFER
SCHEMBL7373897 0.78 G6PC1 (0.57) ALDH1A1MAPTHSP90AA1HPGDGFER
SCHEMBL14667522 0.78 G6PC1 (0.57) ALDH1A1MAPTHSP90AA1HPGDGFER
SCHEMBL2615559 0.78 G6PC1 (0.57) ALDH1A1MAPTHSP90AA1HPGDGFER
SCHEMBL14799744 0.78 ALDH1A1 (0.39) ALDH1A1MAPTHSP90AA1HPGDGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962766-B2 Polymers functionalized with polyhydrazone compounds BRIDGESTONE CORPORATION (JP) 2015-02-24 — — US claimed
US-20130079463-A1 POLYMERS FUNCTIONALIZED WITH POLYHYDRAZONE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2013-03-28 — — US claimed
US-8962766-B2 Polymers functionalized with polyhydrazone compounds BRIDGESTONE CORPORATION (JP) 2015-02-24 — — US disclosed
US-20130079463-A1 POLYMERS FUNCTIONALIZED WITH POLYHYDRAZONE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2013-03-28 — — US disclosed
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