SCHEMBL6695378

SCHEMBL6695378

N=C(N)NC(=N)NCc1ccco1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
GAA P10253 2/20 0.53
ALDH1A1 P00352 8/20 0.47
EPHX2 P34913 3/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
POLB P06746 3/20 0.47
MAPT P10636 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
APEX1 P27695 1/20 0.47
RECQL P46063 1/20 0.47
MEN1 O00255 3/20 0.46
HPGD P15428 3/20 0.45
KDM4E B2RXH2 2/20 0.45
LMNA P02545 1/20 0.45
PTPN7 P35236 1/20 0.45
HSD17B10 Q99714 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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 SCHEMBL8129113 0.98 KMT2A (0.51) KMT2AGAAALDH1A1EPHX2L3MBTL1
SCHEMBL10310225 0.86 KMT2A (0.59) KMT2AGAAALDH1A1EPHX2L3MBTL1
SCHEMBL14868245 0.84 RAB9A (0.43) KMT2AGAAALDH1A1EPHX2L3MBTL1
SCHEMBL10591725 0.83 KMT2A (0.65) KMT2AGAAALDH1A1EPHX2L3MBTL1
SCHEMBL14868617 0.82 ALDH1A1 (0.48) KMT2AGAAALDH1A1EPHX2L3MBTL1
SCHEMBL14868618 0.80 KMT2A (0.47) KMT2AGAAALDH1A1EPHX2POLB
SCHEMBL13584238 0.80 ALDH1A1 (0.46) KMT2AGAAALDH1A1EPHX2L3MBTL1
SCHEMBL14595477 0.79 KMT2A (0.51) KMT2AGAAALDH1A1EPHX2L3MBTL1
Hydrochloric Acid SCHEMBL13584105 0.78 ALDH1A1 (0.44) KMT2AGAAALDH1A1EPHX2L3MBTL1
SCHEMBL14703467 0.76 HTT (0.56) KMT2AGAAALDH1A1L3MBTL1MAPT

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200277255-A1 BIGUANIDE COMPOUND AND USE THEREOF IMMUNOMET THERAPEUTICS INC. 2020-09-03 US claimed
US-20180044283-A1 BIGUANIDE COMPOUND AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2018-02-15 US claimed
EP-3222614-A2 BIGUANIDE COMPOUND AND USE THEREOF Immunomet Therapeutics Inc. (US) 2017-09-27 EP claimed
US-20040063780-A1 Pharmaceutical preparations for treatment of type II diabetes and methods for treatment of type II diabetes CHUGAI SEIYAKU KABUSHIKI KAISHA 2004-04-01 US claimed
CN-1281450-A Substituted 2, 4-diamino-1, 3, 5-triazines and their use as herbicides BAYER AG (DE) 2001-01-24 CN claimed
US-11759441-B2 Biguanide compositions and methods of treating metabolic disorders ANJI PHARMACEUTICALS INC. (US) 2023-09-19 US disclosed
US-11759441-B2 Biguanide compositions and methods of treating metabolic disorders ANJI PHARMACEUTICALS INC. (US) 2023-09-19 US disclosed
US-11572341-B2 Biguanide compound and use thereof IMMUNOMET THERAPEUTICS INC. (US) 2023-02-07 US disclosed
US-11572341-B2 Biguanide compound and use thereof IMMUNOMET THERAPEUTICS INC. (US) 2023-02-07 US disclosed
US-20220151957-A1 BIGUANIDE COMPOSITIONS AND METHODS OF TREATING METABOLIC DISORDERS ANJI PHARMACEUTICALS INC. 2022-05-19 US disclosed
US-11065215-B2 Biguanide compositions and methods of treating metabolic disorders ANJI PHARMA (US) LLC (US) 2021-07-20 US disclosed
US-20200277255-A1 BIGUANIDE COMPOUND AND USE THEREOF IMMUNOMET THERAPEUTICS INC. 2020-09-03 US disclosed
WO-2013103384-A1 BIGUANIDE COMPOSITIONS AND METHODS OF TREATING METABOLIC DISORDERS ELCELYX THERAPEUTICS, INC. (US) 2013-07-11 WO disclosed
US-20130095140-A1 Biguanide Compositions and Methods of Treating Metabolic Disorders ELCELYX THERAPEUTICS, INC. (US) 2013-04-18 US disclosed
US-20130095140-A1 Biguanide Compositions and Methods of Treating Metabolic Disorders ELCELYX THERAPEUTICS, INC. (US) 2013-04-18 US disclosed
US-20040063780-A1 Pharmaceutical preparations for treatment of type II diabetes and methods for treatment of type II diabetes CHUGAI SEIYAKU KABUSHIKI KAISHA 2004-04-01 US disclosed
US-6348435-B1 Substituted 2,4-diamino-1,3,5-triazine and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 2002-02-19 US disclosed
CN-1281450-A Substituted 2, 4-diamino-1, 3, 5-triazines and their use as herbicides BAYER AG (DE) 2001-01-24 CN disclosed
EP-1021441-A1 SUBSTITUTED 2,4-DIAMINO-1,3,5-TRIAZINE AND THEIR USE AS HERBICIDES BAYER AG (DE) 2000-07-26 EP disclosed
WO-1999018100-A1 SUBSTITUTED 2,4-DIAMINO-1,3,5-TRIAZINE AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-04-15 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 (8 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-11065215-B2 Biguanide compositions and methods of treating metabolic disorders SLC5A2, SLC5A1, GPR119 KMT2A 2239/4885GAA 54/4885ALDH1A1 980/4885
US-20130095140-A1 Biguanide Compositions and Methods of Treating Metabolic Disorders SLC5A2, SLC5A1, GPR119 KMT2A 2239/4885GAA 54/4885ALDH1A1 980/4885
US-11759441-B2 Biguanide compositions and methods of treating metabolic disorders SLC5A2, SLC5A1, GPR119 KMT2A 2239/4885GAA 54/4885ALDH1A1 980/4885
US-20180044283-A1 BIGUANIDE COMPOUND AND USE THEREOF MKI67, GCG, GCKR KMT2A 2277/4885GAA 788/4885ALDH1A1 1098/4885
US-11572341-B2 Biguanide compound and use thereof MKI67, GCG, GCKR KMT2A 2277/4885GAA 788/4885ALDH1A1 1098/4885
US-20220151957-A1 BIGUANIDE COMPOSITIONS AND METHODS OF TREATING METABOLIC DISORDERS SLC5A2, SLC5A1, GPR119 KMT2A 2239/4885GAA 54/4885ALDH1A1 980/4885
US-20040063780-A1 Pharmaceutical preparations for treatment of type II diabetes and methods for treatment of type II diabetes SLC5A2, SLC5A1, IAPP KMT2A 3538/4885GAA 746/4885ALDH1A1 1406/4885
US-20200277255-A1 BIGUANIDE COMPOUND AND USE THEREOF MKI67, GCG, GCKR KMT2A 2277/4885GAA 788/4885ALDH1A1 1098/4885

“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.