SCHEMBL2059640

SCHEMBL2059640

O=C(O)c1ccccc1Cl.[KH]

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.95
CES2 O00748 1/20 0.65
CES1 P23141 1/20 0.65
TSHR P16473 2/20 0.64
ALOX15 P16050 1/20 0.62
POLB P06746 2/20 0.58
ERCC5 P28715 1/20 0.53
FEN1 P39748 1/20 0.53
HPGD P15428 4/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 2/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
HMGB1 P09429 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
NAPRT Q6XQN6 1/20 0.52

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
SCHEMBL29369803 0.97 ALDH1A1 (1.00) ALDH1A1CES2CES1TSHRALOX15
SCHEMBL29004189 0.97 ALDH1A1 (1.00) ALDH1A1CES2CES1TSHRALOX15
SCHEMBL29518925 0.97 ALDH1A1 (1.00) ALDH1A1CES2CES1TSHRALOX15
SCHEMBL8482425 0.97 ALDH1A1 (1.00) ALDH1A1CES2CES1TSHRALOX15
SCHEMBL367 0.97 ALDH1A1 (1.00) ALDH1A1CES2CES1TSHRALOX15
SCHEMBL10492061 0.95 ALDH1A1 (0.95) ALDH1A1CES2CES1TSHRALOX15
Hydrochloric Acid SCHEMBL784866 0.95 ALDH1A1 (0.95) ALDH1A1CES2CES1TSHRALOX15
Fluoride SCHEMBL6444932 0.95 ALDH1A1 (0.95) ALDH1A1CES2CES1TSHRALOX15
SCHEMBL6915337 0.95 ALDH1A1 (0.95) ALDH1A1CES2CES1TSHRALOX15
SCHEMBL11768054 0.95 ALDH1A1 (0.95) ALDH1A1CES2CES1TSHRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114843405-A Chlorine-containing organic potassium salt modified perovskite solar cell electron transport layer, perovskite solar cell and preparation method thereof 武汉理工大学 2022-08-02 CN claimed
EP-2383275-A1 METHOD FOR SYNTHESIZING O-DIPHENYLPHOSPHINO BENZOIC ACID Sinomax Chemical Technology Co., Ltd (CN) 2011-11-02 EP claimed
US-20110077426-A1 METHOD FOR SYNTHESIS OF O-DIPHENYLPHOSPHINOBENZOIC ACID SINOMAX CHEMICAL TECHNOLOGY CO. LTD. (CN) 2011-03-31 US claimed
CN-114843405-A Chlorine-containing organic potassium salt modified perovskite solar cell electron transport layer, perovskite solar cell and preparation method thereof 武汉理工大学 2022-08-02 CN disclosed
CN-104557646-B Produce the commercial run of arylsulfur pentafluorides 宇部兴产株式会社 2017-08-29 CN disclosed
CN-106946755-A Produce the commercial run of arylsulfur pentafluorides 宇部兴产株式会社 2017-07-14 CN disclosed
CN-104557646-A Industrial methods for producing arylsulfur pentafluorides UBE INDUSTRIES 2015-04-29 CN disclosed
CN-103380110-A Industrial process for the production of arylsulfur pentafluorides UBE INDUSTRIES 2013-10-30 CN disclosed
EP-2383275-A1 METHOD FOR SYNTHESIZING O-DIPHENYLPHOSPHINO BENZOIC ACID Sinomax Chemical Technology Co., Ltd (CN) 2011-11-02 EP disclosed
US-20110077426-A1 METHOD FOR SYNTHESIS OF O-DIPHENYLPHOSPHINOBENZOIC ACID SINOMAX CHEMICAL TECHNOLOGY CO. LTD. (CN) 2011-03-31 US disclosed
US-20100160351-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR TREATING HYPERURICEMIA AND RELATED DISORDERS NUON THERAPEUTICS, INC. (US) 2010-06-24 US disclosed
EP-0278176-B1 Compounds having antitumour and antibacterial properties WARNER LAMBERT CO (US) 1994-03-09 EP disclosed
US-5281620-A Alkyl substituted xanthenone-4-acetic acid CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1994-01-25 US disclosed
US-4924004-A 1-phenyl-2-aminocarbonylindole compounds, preparation thereof and pharmaceutical compositions containing them KALI-CHEMIE PHARMA GMBH (DE) 1990-05-08 US disclosed
US-4803198-A ANTIARRHYTHMIA AGENTS KALI-CHEMIE PHARMA GMBH (DE) 1989-02-07 US disclosed
EP-0278176-A2 Compounds having antitumour and antibacterial properties WARNER-LAMBERT COMPANY (US) 1988-08-17 EP disclosed
US-3989746-A ANALGESICS, ANTIINFLAMMATORY AGENTS IKEDA MOHANDO CO., LTD. (JA) 1976-11-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100160351-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR TREATING HYPERURICEMIA AND RELATED DISORDERS XDH, SLC10A1, SLC10A6 ALDH1A1 488/4885CES2 1046/4885CES1 314/4885
US-20110077426-A1 METHOD FOR SYNTHESIS OF O-DIPHENYLPHOSPHINOBENZOIC ACID PLCB1, DCPS, POF1B ALDH1A1 2332/4885CES2 1862/4885CES1 2717/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.