SCHEMBL7129733

SCHEMBL7129733

c1ccc(-c2ccc(-c3ccccc3)c(-c3ncco3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.50
LTA4H P09960 1/20 0.49
PIK3CA P42336 1/20 0.42
IMPDH2 P12268 1/20 0.42
FAAH O00519 4/20 0.40
BRD4 O60885 1/20 0.40
PIN1 Q13526 1/20 0.40
MEN1 O00255 1/20 0.40
APAF1 O14727 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
XBP1 P17861 1/20 0.40
PTBP1 P26599 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
GALK1 P51570 1/20 0.40
BLM P54132 1/20 0.40
SMAD3 P84022 1/20 0.40

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
SCHEMBL9510279 0.84 HPGDS (0.58) HPGDSLTA4HIMPDH2BRD4PIN1
SCHEMBL27448711 0.84 HPGDS (0.47) HPGDSLTA4HPIK3CAIMPDH2FAAH
SCHEMBL942521 0.84 HPGDS (0.47) HPGDSLTA4HIMPDH2BRD4PIN1
SCHEMBL15312756 0.83 HPGDS (0.50) HPGDSLTA4HIMPDH2FAAHBRD4
SCHEMBL5701217 0.83 MAPT (0.43) HPGDSLTA4HFAAHBRD4MEN1
SCHEMBL5571760 0.80 LTA4H (0.70) HPGDSLTA4HFAAHNPC1LMNA
SCHEMBL27698256 0.79 HPGDS (0.43) HPGDSLTA4HPIK3CAIMPDH2FAAH
Ammonia Solution, Strong SCHEMBL28198913 0.79 HPGDS (0.43) HPGDSLTA4HIMPDH2FAAHBRD4
SCHEMBL2152660 0.79 HPGDS (0.61) HPGDSLTA4HFAAHCES1MCL1
SCHEMBL16159358 0.78 LTA4H (0.51) HPGDSLTA4HPIK3CAIMPDH2FAAH

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-6515956-B2 Optical recording medium, reproducing apparatus, and recording and reproducing apparatus therefor SONY CORPORATION (JP) 2003-02-04 US disclosed