SCHEMBL237952

SCHEMBL237952

Nc1cc(F)c(N2CCC3(CC2)OCCO3)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGMN Q99538 1/20 0.43
NPC1 O15118 2/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 9/20 0.38
MAPK8 P45983 2/20 0.36
MAPK10 P53779 2/20 0.36
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RCE1 Q9Y256 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FLT3 P36888 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAOA P21397 1/20 0.34
KMT2A Q03164 1/20 0.33

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
SCHEMBL17543003 0.83 NPC1 (0.43) LGMNNPC1RAB9AALDH1A1MAPK8
SCHEMBL12684501 0.83 MAPK8 (0.41) LGMNNPC1RAB9AALDH1A1MAPK8
SCHEMBL15458277 0.80 NPC1 (0.41) LGMNNPC1RAB9AALDH1A1MAPK8
SCHEMBL17543831 0.80 POLB (0.45) NPC1RAB9AALDH1A1LMNAMAPT
SCHEMBL855383 0.80 ALDH1A1 (0.54) LGMNNPC1RAB9AALDH1A1LMNA
SCHEMBL31312959 0.80 ALDH1A1 (0.54) LGMNNPC1RAB9AALDH1A1LMNA
SCHEMBL239854 0.79 MAPT (0.33) ALDH1A1LMNAMAPTMAPK1TDP1
SCHEMBL240699 0.79 PDE9A (0.35) ALDH1A1LMNAMAPTMAPK1TDP1
SCHEMBL239677 0.77 MAPT (0.33) ALDH1A1LMNAMAPTMAPK1TDP1
SCHEMBL17543781 0.77 NPC1 (0.36) LGMNNPC1RAB9AALDH1A1MAPK8

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-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-20170157104-A1 Anti-Viral Compounds ABBVIE INC. (US) 2017-06-08 US disclosed
US-20170157105-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
EP-2692726-A1 Anti-viral compounds Abbvie Inc. (US) 2014-02-05 EP disclosed
EP-2692346-A1 An antiviral 1-phenyl-2,5-dibenzimidazol-5-yl-pyrrolidine derivative Abbvie Inc. (US) 2014-02-05 EP disclosed
EP-2678334-A1 ANTI-VIRAL COMPOUNDS Abbvie Inc. (US) 2014-01-01 EP disclosed
EP-2627651-A1 ANTI-VIRAL COMPOUNDS Abbvie Inc. (US) 2013-08-21 EP disclosed
WO-2012116257-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. (US) 2012-08-30 WO disclosed
US-20120220562-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2012-08-30 US disclosed
WO-2012051361-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-04-19 WO 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 (10 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 LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-20230285378-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-20120220562-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-20170157105-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-20110092415-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-20170157104-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-20110207699-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-20190015402-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-20120004196-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885
US-10039754-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS LGMN 270/4885NPC1 81/4885RAB9A 1535/4885

“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.