SCHEMBL10985995

SCHEMBL10985995

CCCCc1cc(O)c(C)c(-c2ccccc2)c1CCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 2/20 0.45
TYR P14679 3/20 0.42
HTT P42858 2/20 0.41
HPGD P15428 2/20 0.41
NPC1 O15118 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CNR2 P34972 1/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
DCTPP1 Q9H773 1/20 0.40
ADORA3 P0DMS8 1/20 0.38
PSMB5 P28074 1/20 0.38
CYP3A4 P08684 2/20 0.37
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
ALOX5 P09917 1/20 0.37
ALOX15 P16050 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
SCHEMBL27919485 0.89 TYR (0.44) GCGRTYRHTTHPGDNPC1
SCHEMBL28423803 0.84 GCGR (0.50) GCGRTYRHTTHPGDNPSR1
SCHEMBL28247750 0.82 CNR2 (0.42) GCGRTYRHTTHPGDNPC1
SCHEMBL10985993 0.82 GCGR (0.45) GCGRTYRHTTHPGDNPC1
SCHEMBL760580 0.81 GCGR (0.47) GCGRTYRHTTHPGDNPC1
SCHEMBL2527585 0.81 DCTPP1 (0.40) GCGRTYRHTTHPGDNPC1
SCHEMBL11352126 0.80 GCGR (0.46) GCGRTYRHTTHPGDNPC1
SCHEMBL324416 0.80 GCGR (0.46) GCGRTYRHTTHPGDNPC1
SCHEMBL11352114 0.80 GCGR (0.46) GCGRTYRHTTHPGDNPC1
SCHEMBL27308241 0.80 ESR1 (0.46) GCGRCNR2ESR1ESR2DCTPP1

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
CN-116262105-A Voriconazole dry suspension and preparation method thereof 北京万全德众医药生物技术有限公司 2023-06-16 CN disclosed
US-4562115-A MALEIC ANHYDRIDE-MODIFIED POLYBUTADIENE SIZING THE FIRESTONE TIRE & RUBBER COMPANY (US) 1985-12-31 US disclosed
US-4537917-A MALEIC ANHYDRIDE ADDUCT OF POLYBUTADIENE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1985-08-27 US disclosed
US-4524040-A ADDUCT OF MALEIC ANHYDRI-DE WITH POLYBUTADIENE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1985-06-18 US disclosed