SCHEMBL5099460

SCHEMBL5099460

O=C(O)Nc1ccccc1-c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.57
L3MBTL1 Q9Y468 3/20 0.56
NPY1R P25929 2/20 0.56
NPY2R P49146 2/20 0.56
LMNA P02545 1/20 0.56
PLA2G1B P04054 1/20 0.56
THRB P10828 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
ATG4B Q9Y4P1 1/20 0.56
ALDH1A1 P00352 6/20 0.53
SUCNR1 Q9BXA5 2/20 0.50
CHRM2 P08172 1/20 0.50
CHRM1 P11229 1/20 0.50
CHRM3 P20309 1/20 0.50
MEN1 O00255 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50
SLC6A4 P31645 1/20 0.50

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
SCHEMBL265014 0.87 ALDH1A1 (0.62) L3MBTL1NPSR1ALDH1A1MEN1CYP2C9
Hydrochloric Acid SCHEMBL5883332 0.85 ALDH1A1 (0.61) L3MBTL1NPSR1ALDH1A1MEN1CYP2C9
Hydrochloric Acid SCHEMBL380091 0.85 ALDH1A1 (0.61) L3MBTL1NPSR1ALDH1A1MEN1CYP2C9
SCHEMBL5214121 0.84 HSP90AA1 (0.57) TDP1L3MBTL1NPY1RNPY2RLMNA
SCHEMBL31500633 0.84 HSP90AA1 (0.57) TDP1L3MBTL1NPY1RNPY2RLMNA
SCHEMBL16438501 0.84 ALDH1A1 (0.49) TDP1L3MBTL1NPY1RNPY2RLMNA
SCHEMBL5106705 0.84 ALDH1A1 (0.55) L3MBTL1NPY1RNPY2RLMNASMN1; SMN2
SCHEMBL5100118 0.84 MAPT (0.60) L3MBTL1LMNAPLA2G1BSMN1; SMN2ATG4B
SCHEMBL4654120 0.82 ALDH1A1 (0.51) L3MBTL1NPY1RNPY2RLMNANPSR1
SCHEMBL3910619 0.82 ALDH1A1 (0.57) LMNASMN1; SMN2ALDH1A1CHRM3MEN1

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
EP-3029026-B1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG A ST CO LTD (KR) 2018-12-05 EP claimed
US-9828339-B2 Biphenyl derivatives and methods for preparing same DONG-A ST CO., LTD (KR) 2017-11-28 US claimed
US-20160176816-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG-A ST CO., LTD (KR) 2016-06-23 US claimed
EP-3029026-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME Dong-A ST Co., Ltd. (KR) 2016-06-08 EP claimed
EP-3029026-B1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG A ST CO LTD (KR) 2018-12-05 EP disclosed
US-9828339-B2 Biphenyl derivatives and methods for preparing same DONG-A ST CO., LTD (KR) 2017-11-28 US disclosed
US-20160176816-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG-A ST CO., LTD (KR) 2016-06-23 US disclosed
EP-3029026-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME Dong-A ST Co., Ltd. (KR) 2016-06-08 EP disclosed
EP-3029026-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME Dong-A ST Co., Ltd. (KR) 2016-06-08 EP disclosed
WO-2015016511-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME 동아에스티 주식회사 (KR) 2015-02-05 WO disclosed
US-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists LAINE DRAMANE I 2008-10-09 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-20160176816-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME CHRM2, CHRM3, CHRM5 TDP1 1487/4885L3MBTL1 3460/4885NPY1R 366/4885
US-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists CHRM3, CHRNG, CHRM2 TDP1 3416/4885L3MBTL1 1742/4885NPY1R 511/4885

“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.