SCHEMBL239493

SCHEMBL239493

O=[N+]([O-])c1cc([C@H]2CC[C@H](c3ccc(Cl)c([N+](=O)[O-])c3)N2c2ccc(N3CCC(c4ccccc4)CC3)c(F)c2)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.40
KMT2A Q03164 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.40
GPR174 Q9BXC1 2/20 0.39
FFAR2 O15552 3/20 0.39
MAPT P10636 9/20 0.39
ADRA2A P08913 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
ALDH1A1 P00352 5/20 0.37
LMNA P02545 3/20 0.36
HTT P42858 2/20 0.36
HSP90AA1 P07900 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL241805 0.89 KMT2A (0.41) L3MBTL1KMT2ASMN1; SMN2MEN1GPR174
SCHEMBL239621 0.88 KMT2A (0.47) L3MBTL1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL240079 0.88 MAPK1 (0.46) L3MBTL1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL241510 0.87 MAPT (0.47) L3MBTL1SMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL16589619 0.85 KMT2A (0.39) L3MBTL1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL239952 0.85 KMT2A (0.40) L3MBTL1KMT2ASMN1; SMN2MEN1GPR174
SCHEMBL240686 0.82 MAPT (0.36) L3MBTL1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL242322 0.82 KAT2B (0.40) L3MBTL1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL240276 0.81 CNR1 (0.39) L3MBTL1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL15457855 0.81 ADRA2A (0.38) L3MBTL1KMT2ASMN1; SMN2MEN1GPR174

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285378-A1 Anti-Viral Compounds ABBVIE INC. (US) 2023-09-14 US disclosed
EP-3438106-A1 ANTI-VIRAL COMPOUNDS AbbVie Ireland Unlimited Company (IE) 2019-02-06 EP disclosed
US-20190015402-A1 Anti-Viral Compounds ABBVIE INC. (US) 2019-01-17 US disclosed
US-10039754-B2 Anti-viral compounds ABBVIE INC. (US) 2018-08-07 US disclosed
US-10028937-B2 Anti-viral compounds ABBVIE INC. (US) 2018-07-24 US disclosed
US-20170157105-A1 Anti-Viral Compounds ABBVIE INC. (US) 2017-06-08 US disclosed
US-20170157104-A1 Anti-Viral Compounds ABBVIE INC. (US) 2017-06-08 US disclosed
EP-2678334-B1 ANTI-VIRAL COMPOUNDS ABBVIE BAHAMAS LTD (BS) 2017-03-22 EP disclosed
US-9586978-B2 Anti-viral compounds ABBVIE INC. (US) 2017-03-07 US disclosed
EP-2692346-B1 An antiviral 1-phenyl-2,5-dibenzimidazol-5-yl-pyrrolidine derivative ABBVIE BAHAMAS LTD (BS) 2015-12-02 EP disclosed
US-20150087618-A1 Anti-Viral Compounds ABBVIE INC. (US) 2015-03-26 US disclosed
US-8937150-B2 Anti-viral compounds ABBVIE INC. (US) 2015-01-20 US disclosed
US-8921514-B2 Anti-viral compounds ABBVIE INC. (US) 2014-12-30 US disclosed
EP-2692346-A1 An antiviral 1-phenyl-2,5-dibenzimidazol-5-yl-pyrrolidine derivative Abbvie Inc. (US) 2014-02-05 EP disclosed
EP-2692726-A1 Anti-viral compounds Abbvie Inc. (US) 2014-02-05 EP disclosed
US-20120220562-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2012-08-30 US disclosed
US-20120004196-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2012-01-05 US disclosed
US-20110207699-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2011-08-25 US disclosed
US-20110092415-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2011-04-21 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 (11 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-10028937-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20230285378-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20120220562-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20170157105-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20110092415-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20170157104-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20150087618-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20110207699-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20190015402-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-20120004196-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885
US-10039754-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS L3MBTL1 2364/4885KMT2A 4093/4885SMN1; SMN2 4141/4885

“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.