SCHEMBL57618

SCHEMBL57618

[O]C(=O)c1cccc2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.68
NR4A2 P43354 1/20 0.68
NR4A3 Q92570 1/20 0.68
MMP3 P08254 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
CDC25B P30305 2/20 0.59
PTPN1 P18031 1/20 0.59
PLK1 P53350 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.52
PTK2B Q14289 1/20 0.52
POLB P06746 4/20 0.50
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 4/20 0.50
MAPT P10636 4/20 0.50
HPGD P15428 4/20 0.50
MEN1 O00255 3/20 0.50
LMNA P02545 3/20 0.50
NPSR1 Q6W5P4 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
CNR2 P34972 2/20 0.50

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
SCHEMBL1314383 0.87 HPRT1 (0.56) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL29414437 0.83 CDC25B (0.80) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL244802 0.83 CDC25B (0.80) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL29494693 0.83 NR4A1 (0.71) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL7218991 0.83 NR4A1 (0.71) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL23698265 0.83 NR4A1 (0.53) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL7219947 0.82 NR4A1 (0.63) NR4A1NR4A2NR4A3MMP3HDAC8
Naphthoic Acid SCHEMBL29392952 0.82 NR4A1 (0.63) NR4A1NR4A2NR4A3MMP3HDAC8
Naphthoic Acid SCHEMBL5924554 0.82 NR4A1 (0.63) NR4A1NR4A2NR4A3MMP3HDAC8
Naphthoic Acid SCHEMBL17258 0.81 NR4A1 (1.00) NR4A1NR4A2NR4A3MMP3HDAC8

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

Appears in 4365 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112512529-B Cyclopentenepurine derivative or salt thereof 富士胶片株式会社 2024-06-18 CN claimed
WO-2024062998-A1 POLYMER, RESIST COMPOSITION CONTAINING SAID POLYMER, METHOD FOR MANUFACTURING MEMBER USING SAME, AND PATTERN FORMATION METHOD 東洋合成工業株式会社 2024-03-28 WO claimed
CN-113272358-B Ester compound, resin composition, cured product, and laminate film 积水化学工业株式会社 2024-03-26 CN claimed
CN-107976867-B Photosensitive composition and method for forming cured film 东京应化工业株式会社 2024-03-01 CN claimed
EP-4265602-A2 LEOLIGIN DERIVATIVES AS PROLIFERATION INHIBITORS OF SMOOTH MUSCLE CELLS TECHNISCHE UNIVERSITÄT WIEN (AT) 2023-10-25 EP claimed
EP-3561025-B1 LUBRICATING BASE OIL, LUBRICATING OIL COMPOSITION CONTAINING LUBRICATING BASE OIL, AND METHOD FOR PRODUCING LUBRICATING OIL COMPOSITION KAO CORP (JP) 2023-10-18 EP claimed
CN-110088252-B Lubricant base oil, lubricant composition containing the same, and method for producing the same 花王株式会社 2021-12-14 CN claimed
CN-113272358-A Ester compound, resin composition, cured product, and laminated film 积水化学工业株式会社 2021-08-17 CN claimed
US-11034906-B2 2021-06-15 US claimed
CN-106483764-B Photosensitive composition, pattern forming method, cured product, and display device 东京应化工业株式会社 2021-03-30 CN claimed
US-4451473-A 3,7-Diazabicyclo [3.3.1] nonanes having anti-arrhythmic activity RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1984-05-29 US claimed
US-4416879-A CEPHALOSPORINS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-22 US claimed
US-4410522-A BACTERICIDES TOYAMA CHEMICAL CO., LTD. (JP) 1983-10-18 US claimed
US-4292238-A Alkylation of benzthiazole-azo-phenylamine dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1981-09-29 US claimed
US-4281115-A DISPERSE DYES SANDOZ LTD. (CH) 1981-07-28 US claimed
US-4129730-A BACTERICIDES TOYAMA CHEMICAL CO., LTD. (JP) 1978-12-12 US claimed
US-4116241-A FOR CONTROLLED ORAL ADMINISTRATION OF DRUG ALZA CORPORATION (US) 1978-09-26 US claimed
US-4086423-A CEPHALOSPORINS, CYCLOADDITION OF GLYCINE DERIVATIVE TO THIAZINE COMPOUND MERCK & CO., INC. (US) 1978-04-25 US claimed
US-4002640-A ANTIFUNGAL AGENTS SYNTEX (U.S.A.) INC. (US) 1977-01-11 US claimed
US-3936462-A CNS DEPRESSANT, ANALGESIC STERLING DRUG INC. (US) 1976-02-03 US claimed