SCHEMBL11071487

SCHEMBL11071487

Cn1c(-c2ccccc2)cc(=O)n1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 2/20 0.62
TSHR P16473 2/20 0.42
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42
ALDH1A1 P00352 3/20 0.42
ALOX15 P16050 2/20 0.42
BCHE P06276 1/20 0.42
PTGS2 P35354 1/20 0.42
LMNA P02545 3/20 0.41
HPGD P15428 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
HTT P42858 1/20 0.41
GLO1 Q04760 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP1A2 P05177 1/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HSP90AA1 P07900 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
SCHEMBL198259 0.89 NAPRT (0.54) NAPRTTSHRGSK3AGSK3BALDH1A1
SCHEMBL1758432 0.85 NAPRT (0.53) NAPRTTSHRGSK3AGSK3BALDH1A1
SCHEMBL1964715 0.80 ALDH1A1 (0.46) NAPRTTSHRGSK3AGSK3BALDH1A1
Antipyrine SCHEMBL20452 0.77 NAPRT (1.00) NAPRTTSHRGSK3AGSK3BALDH1A1
SCHEMBL7842787 0.76 NAPRT (0.65) NAPRTTSHRGSK3AGSK3BALDH1A1
Antipyrine SCHEMBL18260589 0.76 NAPRT (0.96) NAPRTTSHRGSK3AGSK3BALDH1A1
Antipyrine SCHEMBL28445203 0.76 NAPRT (0.96) NAPRTTSHRGSK3AGSK3BALDH1A1
Antipyrine SCHEMBL8736656 0.76 NAPRT (0.96) NAPRTTSHRGSK3AGSK3BALDH1A1
Antipyrine SCHEMBL8995343 0.76 NAPRT (0.96) NAPRTTSHRGSK3AGSK3BALDH1A1
Antipyrine SCHEMBL9845605 0.76 NAPRT (0.96) NAPRTTSHRGSK3AGSK3BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118026938-B Pyrazolone ester compound and electrochemical synthesis method thereof 江西本草天工科技有限责任公司 2024-06-28 CN claimed
CN-118026938-A Pyrazolone ester compound and electrochemical synthesis method thereof 江西本草天工科技有限责任公司 2024-05-14 CN claimed
US-4268626-A Dry image forming material ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1981-05-19 US claimed
CN-118026938-B Pyrazolone ester compound and electrochemical synthesis method thereof 江西本草天工科技有限责任公司 2024-06-28 CN disclosed
CN-118026938-A Pyrazolone ester compound and electrochemical synthesis method thereof 江西本草天工科技有限责任公司 2024-05-14 CN disclosed
US-4442202-A SILVER HALIDE, REDOX SYSTEM, ORGANOBROMINE COMPOUND, STORAGE STABILITY ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1984-04-10 US disclosed
US-4396712-A ORGANIC SILVER SALT OXIDIZER, REDUCING AGENT, SILVER HALIDE OR SILVER HALIDE FORMER, TONER, BINDER, HYDROXYPHENYLBENZOTRIAZOLE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1983-08-02 US disclosed
US-4332889-A IMPROVED SENSITIVITY, STORAGE STABILITY ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1982-06-01 US disclosed
US-4268626-A Dry image forming material ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1981-05-19 US disclosed