SCHEMBL9667163

SCHEMBL9667163

Cc1cc(CCCCCCCOc2ccc(C3=NCCO3)cc2Cl)on1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.38
SCARB1 Q8WTV0 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GRM2 Q14416 2/20 0.34
NR1I2 O75469 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
HPGD P15428 2/20 0.33
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL9667744 1.00 TDP1 (0.38) TDP1SCARB1NPC1RAB9AMAPT
SCHEMBL9668088 1.00 TDP1 (0.38) TDP1SCARB1NPC1RAB9AMAPT
SCHEMBL9666735 1.00 TDP1 (0.38) TDP1SCARB1NPC1RAB9AMAPT
SCHEMBL9668279 0.99 TDP1 (0.39) TDP1SCARB1NPC1RAB9AMAPT
SCHEMBL28266138 0.92 TDP1 (0.34) TDP1SCARB1NPC1RAB9AMAPT
SCHEMBL9862980 0.91 TDP1 (0.38) TDP1SCARB1NPC1RAB9AMAPT
SCHEMBL9667787 0.90 SCARB1 (0.39) SCARB1KCNH2HRH3MEN1KMT2A
SCHEMBL9705703 0.90 SCARB1 (0.39) SCARB1KCNH2HRH3MEN1KMT2A
SCHEMBL9863055 0.88 SCARB1 (0.36) TDP1SCARB1KCNH2HRH3MEN1
SCHEMBL9862948 0.88 SCARB1 (0.36) SCARB1MAPTKCNH2HRH3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0137242-B1 (SUBSTITUTED) PHENYL-ALIPHATIC-ISOXAZOLES USEFUL AS ANTIVIRAL AGENTS AND PREPARATION THEREOF STERLING WINTHROP INC. (US) 1992-05-13 EP claimed
US-4843087-A OXAZOLINYL COMPOUNDS; RHINOVIRUSES AND PICORNAVIRUSES STERLING DRUG INC. (US) 1989-06-27 US claimed
EP-0137242-A2 (Substituted) Phenyl-aliphatic-isoxazoles useful as antiviral agents and preparation thereof STERLING WINTHROP INC. (US) 1985-04-17 EP claimed
EP-0137242-B1 (SUBSTITUTED) PHENYL-ALIPHATIC-ISOXAZOLES USEFUL AS ANTIVIRAL AGENTS AND PREPARATION THEREOF STERLING WINTHROP INC. (US) 1992-05-13 EP disclosed
US-5002960-A Viricides for combating picornaviruses STERLING DRUG, INC. (US) 1991-03-26 US disclosed
US-4939267-A Viricides STERLING DRUG INC. (US) 1990-07-03 US disclosed
US-4843087-A OXAZOLINYL COMPOUNDS; RHINOVIRUSES AND PICORNAVIRUSES STERLING DRUG INC. (US) 1989-06-27 US disclosed
EP-0137242-A2 (Substituted) Phenyl-aliphatic-isoxazoles useful as antiviral agents and preparation thereof STERLING WINTHROP INC. (US) 1985-04-17 EP disclosed