SCHEMBL7058892

SCHEMBL7058892

O=C(NCCc1ccccc1)Nc1nccs1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.80
L3MBTL1 Q9Y468 1/20 0.80
KDM4E B2RXH2 2/20 0.63
AURKA O14965 1/20 0.61
PIM1 P11309 1/20 0.61
CDK2 P24941 1/20 0.61
GSK3B P49841 1/20 0.61
ROCK2 O75116 2/20 0.59
ROCK1 Q13464 2/20 0.59
MMP3 P08254 1/20 0.56
ATG4B Q9Y4P1 1/20 0.56
USP2 O75604 1/20 0.55
LMNA P02545 1/20 0.55
TSHR P16473 1/20 0.55
NPC1 O15118 4/20 0.55
RAB9A P51151 3/20 0.55
EPHX1 P07099 1/20 0.55
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
TP53 P04637 1/20 0.52

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 SCHEMBL17186300 0.99 SMN1; SMN2 (0.78) SMN1; SMN2L3MBTL1KDM4EAURKAPIM1
SCHEMBL17186221 0.86 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1KDM4ETSHRNPC1
SCHEMBL3510455 0.86 KDM4E (0.79) SMN1; SMN2L3MBTL1KDM4EAURKAPIM1
Hydrochloric Acid SCHEMBL17186439 0.85 SMN1; SMN2 (0.60) SMN1; SMN2L3MBTL1KDM4ETSHRNPC1
Hydrochloric Acid SCHEMBL18605769 0.84 KDM4E (0.77) SMN1; SMN2L3MBTL1KDM4EAURKAPIM1
SCHEMBL1520344 0.83 SMN1; SMN2 (0.71) SMN1; SMN2L3MBTL1KDM4ELMNANPC1
SCHEMBL1458948 0.80 PKM (0.67) SMN1; SMN2L3MBTL1KDM4EUSP2LMNA
Hydrochloric Acid SCHEMBL11320626 0.79 SMN1; SMN2 (0.65) SMN1; SMN2L3MBTL1KDM4EAURKAPIM1
SCHEMBL6032606 0.78 EPHX1 (0.85) SMN1; SMN2L3MBTL1KDM4EMMP3TSHR
SCHEMBL18956343 0.78 ALDH1A1 (0.70) SMN1; SMN2L3MBTL1KDM4EUSP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2017-03-16 US claimed
EP-3131877-A1 GUANIDINE COMPOUNDS AND USE THEREOF Immunomet Therapeutics Inc. (US) 2017-02-22 EP claimed
CN-106458868-A Guanidine compounds and uses thereof 伊谬诺米特医疗有限公司 2017-02-22 CN claimed
WO-2015160220-A1 GUANIDINE COMPOUNDS AND USE THEREOF HANALL BIOPHARMA CO., LTD. (KR) 2015-10-22 WO claimed
CN-111848494-B Guanidine compounds and uses thereof 伊谬诺米特医疗有限公司 2023-08-01 CN disclosed
EP-3131877-B1 BIGUANIDE COMPOUNDS IMMUNOMET THERAPEUTICS INC (US) 2023-07-19 EP disclosed
EP-3131877-B1 BIGUANIDE COMPOUNDS IMMUNOMET THERAPEUTICS INC (US) 2023-07-19 EP disclosed
US-11465989-B2 Guanidine compounds and use thereof ImmunoMet Therapeutics, Inc. (US) 2022-10-11 US disclosed
CN-111848494-A Guanidine compounds and uses thereof 伊谬诺米特医疗有限公司 2020-10-30 CN disclosed
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2017-03-16 US disclosed
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2017-03-16 US disclosed
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC. (US) 2017-03-16 US disclosed
WO-2015160220-A1 GUANIDINE COMPOUNDS AND USE THEREOF HANALL BIOPHARMA CO., LTD. (KR) 2015-10-22 WO disclosed
US-20040116418-A1 Compounds and methods for inhibition of HIV and related viruses MEDIVIR AB (SE) 2004-06-17 US disclosed
US-20020132794-A1 Compounds and methods for inhibition of HIV and related viruses MEDIVIR AB 2002-09-19 US disclosed
US-6376492-B1 GUANIDINE DERIVATIVES MEDIVIR AB (SE) 2002-04-23 US disclosed
US-5849769-A N-arylalkyl-N-heteroarylurea and guandine compounds and methods of treating HIV infection MEDIVIR AB (SE) 1998-12-15 US disclosed
EP-0706514-B1 COMPOUNDS AND METHODS FOR INHIBITION OF HIV AND RELATED VIRUSES MEDIVIR AB (SE) 1998-11-18 EP disclosed
EP-0706514-A1 COMPOUNDS AND METHODS FOR INHIBITION OF HIV AND RELATED VIRUSES MEDIVIR AB (SE) 1996-04-17 EP disclosed
WO-1995006034-A1 COMPOUNDS AND METHODS FOR INHIBITION OF HIV AND RELATED VIRUSES MEDIVIR AB (SE) 1995-03-02 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 (3 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-11465989-B2 Guanidine compounds and use thereof PC, TFAM, PCK2 SMN1; SMN2 1943/4885L3MBTL1 2820/4885KDM4E 659/4885
US-20170073331-A1 GUANIDINE COMPOUNDS AND USE THEREOF PC, TFAM, PCK2 SMN1; SMN2 1943/4885L3MBTL1 2820/4885KDM4E 659/4885
US-20020132794-A1 Compounds and methods for inhibition of HIV and related viruses POLRMT, POLM, POLR1E SMN1; SMN2 4248/4885L3MBTL1 1445/4885KDM4E 1470/4885

“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.