SCHEMBL351013

SCHEMBL351013

O=C(C(Cl)=Cc1ccccc1)C(Cl)=Cc1ccccc1.[Pd].[Pd]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.50
RAB9A P51151 5/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
NPC1 O15118 4/20 0.50
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 4/20 0.50
NFKB1 P19838 3/20 0.50
NFKB2 Q00653 3/20 0.50
RELA Q04206 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
MEN1 O00255 2/20 0.50
FBP1 P09467 1/20 0.48
AKR1C3 P42330 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 1/20 0.47
AKR1C1 Q04828 1/20 0.47
LMNA P02545 2/20 0.46
TSHR P16473 1/20 0.43
CYP2C9 P11712 2/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL28387423 1.00 MAPT (0.50) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL361951 0.98 MAPT (0.51) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL27608353 0.84 MAPT (0.51) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL27669282 0.84 AKR1C3 (0.56) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL1497440 0.84 AKR1C3 (0.56) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL211298 0.84 AKR1C3 (0.56) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL6438925 0.83 FBP1 (0.52) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL18264401 0.82 AKR1C3 (0.59) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL11007893 0.82 AKR1C3 (0.59) MAPTRAB9ASMN1; SMN2NPC1KMT2A
SCHEMBL6064620 0.82 AKR1C3 (0.59) MAPTRAB9ASMN1; SMN2NPC1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9802903-B2 Process for preparing antiviral compound ABBVIE INC. (US) 2017-10-31 US claimed
EP-2593439-B1 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS ABBVIE BAHAMAS LTD (BS) 2016-08-17 EP claimed
US-20160060228-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND ABBOTT LABORATORIES 2016-03-03 US claimed
US-9216952-B2 Process for preparing antiviral compound ABBVIE INC. (US) 2015-12-22 US claimed
EP-2411372-B1 PROCESS FOR PREPARING AN ANTIVIRAL COMPOUND ABBVIE BAHAMAS LTD (BS) 2014-07-23 EP claimed
EP-2593439-A2 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS Abbvie Inc. (US) 2013-05-22 EP claimed
EP-2411372-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND Abbott Laboratories (US) 2012-02-01 EP claimed
WO-2012009699-A2 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-01-19 WO claimed
US-20120014913-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-01-19 US claimed
US-20110237793-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND ABBOTT LABORATORIES (US) 2011-09-29 US claimed
WO-2010111348-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND ABBOTT LABORATORIES (US) 2010-09-30 WO claimed
EP-3415504-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS AbbVie Ireland Unlimited Company (IE) 2018-12-19 EP disclosed
EP-3056486-B1 PROCESS FOR PREPARING INTERMEDIATES FOR ANTIVIRAL COMPOUNDS ABBVIE IRELAND UNLIMITED CO (IE) 2018-07-11 EP disclosed
US-9802903-B2 Process for preparing antiviral compound ABBVIE INC. (US) 2017-10-31 US disclosed
EP-2593439-B1 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS ABBVIE BAHAMAS LTD (BS) 2016-08-17 EP disclosed
EP-2411372-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND Abbott Laboratories (US) 2012-02-01 EP disclosed
WO-2012009699-A2 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-01-19 WO disclosed
US-20120014913-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2012-01-19 US disclosed
US-20110237793-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND ABBOTT LABORATORIES (US) 2011-09-29 US disclosed
WO-2010111348-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND ABBOTT LABORATORIES (US) 2010-09-30 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-20110237793-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND ZC3HAV1, HAVCR2, MAVS MAPT 3779/4885RAB9A 756/4885SMN1; SMN2 3493/4885
US-20160060228-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUND ZC3HAV1, HAVCR2, MAVS MAPT 3779/4885RAB9A 756/4885SMN1; SMN2 3493/4885
US-20120014913-A1 PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS HAVCR2, MAVS, RNASE1 MAPT 4108/4885RAB9A 771/4885SMN1; SMN2 2926/4885

“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.