SCHEMBL250473

SCHEMBL250473

O=[N+]([O-])c1ccc(CCO)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 1.00
LOXL2 Q9Y4K0 1/20 0.57
KCNJ1 P48048 3/20 0.56
KCNH2 Q12809 2/20 0.56
ALDH1A1 P00352 1/20 0.55
CYP2C19 P33261 1/20 0.55
HRH3 Q9Y5N1 1/20 0.53
IDO1 P14902 3/20 0.52
HDAC6 Q9UBN7 1/20 0.51
AKR1C3 P42330 1/20 0.50
POLB P06746 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
Methyl Alcohol SCHEMBL5318262 0.96 TSHR (0.92) TSHRLOXL2KCNJ1KCNH2ALDH1A1
SCHEMBL3887887 0.94 TSHR (0.89) TSHRLOXL2KCNJ1KCNH2ALDH1A1
SCHEMBL11364453 0.89 TSHR (0.79) TSHRLOXL2KCNJ1KCNH2ALDH1A1
SCHEMBL1449170 0.89 TSHR (0.79) TSHRKCNJ1KCNH2ALDH1A1IDO1
SCHEMBL378397 0.88 TSHR (0.78) TSHRLOXL2KCNJ1KCNH2ALDH1A1
SCHEMBL9196397 0.86 TSHR (0.74) TSHRLOXL2KCNJ1KCNH2ALDH1A1
SCHEMBL28771711 0.86 TSHR (0.74) TSHRKCNH2ALDH1A1
SCHEMBL3292782 0.86 TSHR (0.75) TSHRLOXL2KCNJ1KCNH2ALDH1A1
SCHEMBL358325 0.86 TSHR (0.75) TSHRLOXL2KCNJ1KCNH2ALDH1A1
Benzoic Acid SCHEMBL8816046 0.85 TSHR (0.72) TSHRALDH1A1HDAC6POLBMEN1

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 926 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3015467-B1 MORPHOLINO OLIGONUCLEOTIDE MANUFACTURING METHOD AJINOMOTO KK (JP) 2024-12-04 EP claimed
CN-118048096-B High-sewage-resistance epoxy coating and preparation method thereof 广东安捷伦新材料科技有限公司 2024-08-30 CN claimed
CN-118084688-A Preparation method of 2-hydroxy-4-ethylaniline and hydrochloride thereof 浙江鼎龙科技股份有限公司 2024-05-28 CN claimed
CN-118048096-A High-sewage-resistance epoxy coating and preparation method thereof 广东安捷伦新材料科技有限公司 2024-05-17 CN claimed
CN-116693397-A Purification method of p-nitrophenylacetic acid 枣阳星耀化工有限公司 2023-09-05 CN claimed
CN-112239541-A Dielectric elastomer material with high dielectric constant, low modulus and high breakdown field strength and preparation method thereof 北京化工大学 2021-01-19 CN claimed
CN-108538591-A A kind of heat safe conducting high polymers object electrolytic capacitor and preparation method thereof 常州华威电子有限公司 2018-09-14 CN claimed
WO-2018148224-A1 PHOSPHOLIPID ETHER (PLE) CAR T CELL TUMOR TARGETING (CTCT) AGENTS Seattle Children's Hospital (dba Seattle Children's Research Institute) (US) 2018-08-16 WO claimed
CN-108033888-A A kind of preparation method of equal amido phenenyl alcohol 苏州盖德精细材料有限公司 2018-05-15 CN claimed
CN-107537565-A Cross linked amphoteric polymeric supported precious metal catalyst and preparation and alcohol method for oxidation 中国科学院大连化学物理研究所 2018-01-05 CN claimed
US-5874553-A ANTIBODIES; INHIBITOR OF GENE EXPRESSION HOECHST AKTIENGESELLSCHAFT (DE) 1999-02-23 US claimed
US-5721350-A Deuterated nucleosides CHATTOPADHYAYA JYOTI (SE) 1998-02-24 US claimed
WO-1995029184-A1 POLYCATIONIC NUCLEIC BASES AND OLIGONUCLEOTIDES CONTAINING SAME UNIVERSITE LOUIS PASTEUR (FR) 1995-11-02 WO claimed
EP-0640091-A4 SYNTHESIS OF NUCLEOTIDE MONOMERS. RIBOZYME PHARM INC (US) 1995-07-26 EP claimed
EP-0648220-A1 DEUTERATED NUCLEOSIDES CHATTOPADHYAYA, Jyoti (SE) 1995-04-19 EP claimed
EP-0640091-A1 SYNTHESIS OF NUCLEOTIDE MONOMERS RIBOZYME PHARMACEUTICALS, INC. (US) 1995-03-01 EP claimed
WO-1993025566-A1 DEUTERATED NUCLEOSIDES CHATTOPADHYAYA JYOTI (SE) 1993-12-23 WO claimed
WO-1993023413-A1 SYNTHESIS OF NUCLEOTIDE MONOMERS RIBOZYME PHARMACEUTICALS, INC. (US) 1993-11-25 WO claimed
US-5164515-A Chemical compounds WENDSTONE CHEMICALS PLC (GB) 1992-11-17 US claimed
EP-0239354-A2 2,2-Dinitrophenylethane derivatives and their application as protecting compounds Wendstone Chemicals P.L.C. (GB) 1987-09-30 EP claimed