SCHEMBL922752

SCHEMBL922752

O=C(O)c1cc(Oc2ccccc2)ccc1F

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.57
AKR1C3 P42330 1/20 0.53
CYP2C9 P11712 2/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
DHODH Q02127 1/20 0.49
SRD5A2 P31213 2/20 0.49
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
KDM4E B2RXH2 1/20 0.47
ADRB1 P08588 1/20 0.47
ADRB3 P13945 1/20 0.47
CYP1A2 P05177 1/20 0.47
KLF5 Q13887 1/20 0.47
SERPINE1 P05121 1/20 0.47
KMT2A Q03164 1/20 0.46
PARP10 Q53GL7 1/20 0.46
MAPK1 P28482 1/20 0.46
GFER P55789 1/20 0.46

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
Hydrochloric Acid SCHEMBL921227 0.98 POLB (0.55) POLBAKR1C3CYP2C9CYP3A4CYP2C19
SCHEMBL29170790 0.88 FFAR4 (0.51) POLBAKR1C3CYP2C9CYP3A4CYP2C19
SCHEMBL921225 0.86 ALDH1A1 (0.52) POLBAKR1C3CYP2C9CYP3A4CYP2C19
SCHEMBL920637 0.86 PARP10 (0.56) POLBAKR1C3CYP2C9CYP3A4CYP2C19
SCHEMBL27245275 0.86 SRD5A2 (0.57) POLBAKR1C3CYP2C9CYP3A4CYP2C19
SCHEMBL29170788 0.85 PARP10 (0.54) POLBKDM4EPARP10
SCHEMBL522949 0.83 POLB (0.77) POLBAKR1C3CYP2C9CYP2C19SRD5A2
SCHEMBL30287662 0.83 POLB (0.77) POLBAKR1C3CYP2C9CYP2C19SRD5A2
SCHEMBL20522821 0.83 ADRB1 (0.57) FFAR4ADRB1ADRB3
SCHEMBL13070409 0.82 LTA4H (0.44) POLBAKR1C3CYP2C9CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447460-A Heterocyclic compounds as RIPK1 inhibitors 南京天印健华医药科技有限公司 2024-01-26 CN disclosed
WO-2024012425-A1 HETEROCYCLIC COMPOUND AS RIPK1 INHIBITOR 南京天印健华医药科技有限公司 2024-01-18 WO disclosed
WO-2023119210-A1 NOVEL COMPOUND AS RIPK1 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 제일약품주식회사 2023-06-29 WO disclosed
WO-2023119210-A1 NOVEL COMPOUND AS RIPK1 INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 제일약품주식회사 2023-06-29 WO disclosed
CN-101951771-A Composition for agricultural use for controlling or preventing plant diseases caused by plant pathogens SUMITOMO CHEMICAL CO 2011-01-19 CN disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed
WO-2009107764-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS 住友化学株式会社 (JP) 2009-09-03 WO 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 (1 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 POLB 4159/4885AKR1C3 1953/4885CYP2C9 2100/4885

“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.