SCHEMBL1986354

SCHEMBL1986354

OC(CCC(O)c1ccc(Br)cc1)c1ccc(Br)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 6/20 0.43
HMOX1 P09601 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP2A6 P11509 1/20 0.42
HTR2A P28223 1/20 0.41
CXCR3 P49682 1/20 0.41
SLC18A3 Q16572 1/20 0.41
CYP1A2 P05177 1/20 0.40
ALOX5 P09917 1/20 0.39
HTR3A P46098 1/20 0.39

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
SCHEMBL241160 1.00 IGF1R (0.43) IGF1RHMOX1MEN1KMT2ACYP2A6
SCHEMBL2368070 1.00 IGF1R (0.43) IGF1RHMOX1MEN1KMT2ACYP2A6
SCHEMBL30096318 0.90 IGF1R (0.41) IGF1RHMOX1MEN1KMT2ACYP2A6
SCHEMBL29761241 0.89 AOC3 (0.43) IGF1RHMOX1MEN1KMT2ACXCR3
SCHEMBL16070654 0.88 IGF1R (0.40) IGF1RHMOX1MEN1KMT2ACYP2A6
SCHEMBL3175979 0.88 IGF1R (0.40) IGF1RHMOX1MEN1KMT2ACYP2A6
SCHEMBL16070705 0.88 IGF1R (0.40) IGF1RHMOX1MEN1KMT2ACYP2A6
SCHEMBL3839205 0.88 IGF1R (0.40) IGF1RHMOX1MEN1KMT2ACYP2A6
SCHEMBL6111588 0.86 KMT2A (0.41) IGF1RHMOX1KMT2ACXCR3CYP1A2
SCHEMBL16070602 0.86 IGF1R (0.39) IGF1RHMOX1MEN1KMT2AHTR2A

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-20190015402-A1 Anti-Viral Compounds ABBVIE INC. (US) 2019-01-17 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-9586978-B2 Anti-viral compounds ABBVIE INC. (US) 2017-03-07 US disclosed
EP-2628481-B1 Trisubstituted heterocycles as replication inhibitors of hepatitis C virus HCV ABBVIE BAHAMAS LTD (BS) 2016-02-24 EP disclosed
US-20150218194-A1 Anti-Viral Compounds ABBVIE INC. (US) 2015-08-06 US disclosed
US-9006387-B2 Anti-viral compounds ABBVIE INC. (US) 2015-04-14 US disclosed
EP-2853531-A2 Antiviral compounds AbbVie Bahamas Ltd. (BS) 2015-04-01 EP disclosed
EP-2455376-B1 Heterocyclic compounds as inhibitors of hepatitis C virus (HCV) ABBVIE BAHAMAS LTD (BS) 2014-11-26 EP disclosed
US-20140315792-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES 2014-10-23 US disclosed
EP-2337781-B1 ANTI-VIRAL COMPOUNDS TO TREAT HCV INFECTION ABBVIE BAHAMAS LTD (BS) 2014-07-23 EP disclosed
EP-2368890-B9 Hepatitis C virus inhibitors ABBVIE BAHAMAS LTD (BS) 2013-10-30 EP disclosed
EP-2628481-A1 Trisubstituted heterocycles as replication inhibitors of hepatitis C virus HCV AbbVie Bahamas Ltd. (BS) 2013-08-21 EP disclosed
EP-2368890-B1 Hepatitis C virus inhibitors ABBVIE BAHAMAS LTD (BS) 2013-04-17 EP disclosed
EP-2455376-A1 Heterocyclic compounds as inhibitors of hepatitis C virus (HCV) Abbott Laboratories (US) 2012-05-23 EP disclosed
EP-2368890-A1 Hepatitis C virus inhibitors Abbott Laboratories (US) 2011-09-28 EP disclosed
EP-2337781-A2 ANTI-VIRAL COMPOUNDS TO TREAT HCV INFECTION Abbott Laboratories (US) 2011-06-29 EP disclosed
US-20100317568-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2010-12-16 US disclosed
WO-2010144646-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2010-12-16 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 (6 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-20100317568-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS IGF1R 4713/4885HMOX1 419/4885MEN1 4681/4885
US-10028937-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS IGF1R 4713/4885HMOX1 419/4885MEN1 4681/4885
US-20140315792-A1 ANTI-VIRAL COMPOUNDS HAVCR2, EIF2AK2, MAVS IGF1R 4713/4885HMOX1 419/4885MEN1 4681/4885
US-20170157105-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS IGF1R 4713/4885HMOX1 419/4885MEN1 4681/4885
US-20150218194-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS IGF1R 4713/4885HMOX1 419/4885MEN1 4681/4885
US-20190015402-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS IGF1R 4713/4885HMOX1 419/4885MEN1 4681/4885

“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.