SCHEMBL20537201

SCHEMBL20537201

CN(C(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(C(=O)Cl)c1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
ATM Q13315 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TSHR P16473 1/20 0.40
CES1 P23141 2/20 0.39
CES2 O00748 1/20 0.38
GAA P10253 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTT P42858 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL20474769 0.85 CRHBP (0.46) ALDH1A1CRHBPCRHR2ATMMAPK1
SCHEMBL1807706 0.84 GRM1 (0.40) ALDH1A1RAB9AKMT2A
SCHEMBL1803701 0.83 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL7368622 0.78 MAPK1 (0.53) ALDH1A1CRHBPCRHR2ATMMAPK1
SCHEMBL7375141 0.77 CRHBP (0.50) ALDH1A1CRHBPCRHR2ATMMAPK1
SCHEMBL30981379 0.77 CRHBP (0.50) ALDH1A1CRHBPCRHR2ATMMAPK1
SCHEMBL7375065 0.76 CRHBP (0.52) ALDH1A1CRHBPCRHR2ATMMAPK1
SCHEMBL20536772 0.75 ALDH1A1 (0.46) ALDH1A1CES1CES2MEN1KMT2A
SCHEMBL10373835 0.75 ATM (0.54) ALDH1A1CRHBPCRHR2ATMMAPK1
SCHEMBL7371730 0.75 CRHBP (0.51) ALDH1A1CRHBPCRHR2ATMMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3392236-B1 METHOD FOR PRODUCING AROMATIC AMIDE DERIVATIVE MITSUI CHEMICALS AGRO INC (JP) 2021-06-23 EP disclosed
CN-108368030-B Process for producing aromatic amide derivative 三井化学AGRO株式会社 2020-09-18 CN disclosed
US-10647660-B2 Method of producing aromatic amide derivative MITSUI CHEMICALS AGRO, INC. (JP) 2020-05-12 US disclosed
US-20180362447-A1 METHOD OF PRODUCING AROMATIC AMIDE DERIVATIVE MITSUI CHEMICALS AGRO, INC. (JP) 2018-12-20 US disclosed
EP-3392236-A1 METHOD FOR PRODUCING AROMATIC AMIDE DERIVATIVE Mitsui Chemicals Agro, Inc. (JP) 2018-10-24 EP 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-20180362447-A1 METHOD OF PRODUCING AROMATIC AMIDE DERIVATIVE HDHD5, NAAA, H1-4 ALDH1A1 461/4885CRHBP 3178/4885CRHR2 2298/4885
US-10647660-B2 Method of producing aromatic amide derivative HDHD5, NAAA, H1-4 ALDH1A1 461/4885CRHBP 3178/4885CRHR2 2298/4885

“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.