SCHEMBL9843748

SCHEMBL9843748

O=C(CF)Nc1ccc(F)cc1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.66
ALDH1A1 P00352 4/20 0.61
HDAC3 O15379 2/20 0.58
HDAC1 Q13547 2/20 0.58
HDAC2 Q92769 2/20 0.58
HDAC6 Q9UBN7 2/20 0.58
KMT2A Q03164 3/20 0.56
KDM4E B2RXH2 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
THRB P10828 1/20 0.56
POLB P06746 2/20 0.53
TGM2 P21980 1/20 0.52
MAPT P10636 2/20 0.51
MEN1 O00255 2/20 0.51
ATM Q13315 1/20 0.51
TP53 P04637 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51

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
SCHEMBL1753925 0.86 GAA (0.70) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL9386081 0.83 HDAC3 (0.64) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL1134070 0.83 CYP1A1 (0.60) GAAALDH1A1KMT2AKDM4ETHRB
SCHEMBL6794740 0.83 GAA (0.66) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL27519377 0.81 TP53 (0.58) GAAALDH1A1KMT2ASMN1; SMN2POLB
SCHEMBL4807819 0.81 TRPV1 (0.47) GAAALDH1A1HDAC1HDAC6KMT2A
SCHEMBL1525924 0.81 GAA (0.63) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL5804257 0.81 GAA (0.63) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL105772 0.81 GAA (0.63) GAAALDH1A1HDAC3HDAC1HDAC2
SCHEMBL5804254 0.81 GAA (0.63) GAAALDH1A1HDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115707739-B Waterproof fiber board and preparation method thereof 河北鑫鑫木业有限公司 2024-02-23 CN claimed
CN-115707739-A Water-resistant fiberboard and preparation method thereof 河北鑫鑫木业有限公司 2023-02-21 CN claimed
CN-115707739-B Waterproof fiber board and preparation method thereof 河北鑫鑫木业有限公司 2024-02-23 CN disclosed
US-20230337677-A1 ARYL AND PYRIDYL AMIDE PESTICIDES AND COMPOSITIONS THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2023-10-26 US disclosed
CN-115707739-A Water-resistant fiberboard and preparation method thereof 河北鑫鑫木业有限公司 2023-02-21 CN disclosed
CN-101270097-B Process for production of 1-aryl-5-(trifluoromethyl)-1H-tetrazoles TOYO BOSEKI 2011-04-13 CN disclosed
CN-100424069-C Preparation method of N-aryl-2, 2, 2-trifluoro acetimidoyl chloride TOYO KASEI KOGYO CO LTD (JP) 2008-10-08 CN disclosed
CN-101270097-A Process for production of 1-aryl-5-(trifluoromethyl)-1H-tetrazoles TOYO KASEI KOGYO CO LTD (JP) 2008-09-24 CN disclosed
CN-1863765-A Preparation method of 1-aryl-5- (trifluoromethyl) -1H-tetrazole TOYO KASEI KOGYO CO LTD (JP) 2006-11-15 CN disclosed
EP-0413832-A1 OXAZOLIDINEDIONE DERIVATIVES AND PRODUCTION THEREOF SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-02-27 EP disclosed
US-4766243-A Electrophilic fluorination of aromatic compounds OCCIDENTAL CHEMICAL CORPORATION (US) 1988-08-23 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 (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-20230337677-A1 ARYL AND PYRIDYL AMIDE PESTICIDES AND COMPOSITIONS THEREOF DDT, ACHE, AHR GAA 4686/4885ALDH1A1 2254/4885HDAC3 143/4885

“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.