SCHEMBL2756282

SCHEMBL2756282

CCOC(=O)C(Br)CCC(Br)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.40
ALDH1A1 P00352 3/20 0.37
TRPA1 O75762 1/20 0.37
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SOAT1 P35610 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
CPB2 Q96IY4 1/20 0.33
KMT2A Q03164 3/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
POLB P06746 1/20 0.32
LCK P06239 1/20 0.31
PPARD Q03181 1/20 0.31

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
SCHEMBL10261749 1.00 ZDHHC7 (0.40) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL36999 0.89 ZDHHC7 (0.47) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL240521 0.89 ZDHHC7 (0.47) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL20328792 0.81 ALDH1A1 (0.39) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL14815369 0.81 LCK (0.50) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL14616915 0.81 ALDH1A1 (0.42) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL10569161 0.81 ZDHHC7 (0.41) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL1732719 0.80 ZDHHC7 (0.48) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL1415641 0.80 ZDHHC7 (0.53) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10
SCHEMBL304907 0.80 ZDHHC7 (0.48) ZDHHC7ALDH1A1TRPA1LMNAHSD17B10

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 16 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
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
US-9586978-B2 Anti-viral compounds ABBVIE INC. (US) 2017-03-07 US 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
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
US-20140315792-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES 2014-10-23 US 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 (12 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 ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20230285378-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20120220562-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20140315792-A1 ANTI-VIRAL COMPOUNDS HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20170157105-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20110092415-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20170157104-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20150087618-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20110207699-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20150218194-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-20120004196-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885
US-10039754-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS ZDHHC7 805/4885ALDH1A1 2858/4885TRPA1 4273/4885

“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.