SCHEMBL9475688

SCHEMBL9475688

O=[PH](Oc1ccccc1)c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.39
NR4A1 P22736 1/20 0.37
NR4A2 P43354 1/20 0.37
NR4A3 Q92570 1/20 0.37
ALDH1A1 P00352 7/20 0.37
HSD17B10 Q99714 4/20 0.37
KDM4E B2RXH2 4/20 0.37
PGR P06401 1/20 0.36
TDP1 Q9NUW8 4/20 0.35
HPGD P15428 3/20 0.35
CYP2A6 P11509 3/20 0.34
TSHR P16473 3/20 0.34
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
CDC25B P30305 2/20 0.33
KEAP1 Q14145 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PARP10 Q53GL7 1/20 0.33
MAPT P10636 3/20 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
SCHEMBL7764949 0.83 ALDH1A1 (0.41) KCNA3ALDH1A1HSD17B10KDM4EPGR
SCHEMBL9807569 0.81 ALDH1A1 (0.44) KCNA3ALDH1A1HSD17B10KDM4EPGR
SCHEMBL28171688 0.77 MAPT (0.42) ALDH1A1HSD17B10KDM4EPGRTDP1
SCHEMBL29756523 0.73 ALDH1A1 (0.46) NR4A1NR4A2NR4A3ALDH1A1HSD17B10
SCHEMBL184468 0.73 ALDH1A1 (0.46) NR4A1NR4A2NR4A3ALDH1A1HSD17B10
SCHEMBL27769867 0.73 HPGD (0.34) TDP1HPGDTSHRNPC1RAB9A
SCHEMBL27866665 0.73 HPGD (0.40) ALDH1A1HSD17B10KDM4ETDP1HPGD
SCHEMBL9559628 0.73 HPGD (0.41) ALDH1A1KDM4EHPGDCYP2A6TSHR
SCHEMBL27918672 0.73 KCNA3 (0.49) KCNA3ALDH1A1HSD17B10KDM4EPGR
SCHEMBL18148633 0.71 LTA4H (0.38) KCNA3TDP1TSHRPARP10ALOX15

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-5191000-A FLAMEPROOFED, NON-DRIPPING POLYALKYLENE TEREPHTHALATE MOLDING COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1993-03-02 US disclosed