SCHEMBL16646709

SCHEMBL16646709

CC(=O)CCSSC(C)CCC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
SLC15A2 Q16348 1/20 0.36
TSHR P16473 1/20 0.32
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 2/20 0.31
GABRB2 P47870 2/20 0.31
GABRA4 P48169 2/20 0.31
GABRE P78334 2/20 0.31
GABRA6 Q16445 2/20 0.31
GABRG1 Q8N1C3 2/20 0.31
GABRG3 Q99928 2/20 0.31
GABRQ Q9UN88 2/20 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
SCHEMBL15691923 0.87 LMNA (0.30) ALDH1A1LMNASLC15A2TDP1
SCHEMBL25641491 0.83 ALDH1A1 (0.36) ALDH1A1LMNASLC15A2TDP1
SCHEMBL18494808 0.81 ALDH1A1 (0.41) ALDH1A1LMNA
SCHEMBL19456824 0.78 ALDH1A1 (0.39) ALDH1A1LMNASLC15A2TDP1
SCHEMBL19456825 0.78 ALDH1A1 (0.39) ALDH1A1LMNASLC15A2TDP1
SCHEMBL25641496 0.78 ALDH1A1 (0.39) ALDH1A1LMNASLC15A2TDP1
SCHEMBL16643860 0.78 TSHR (0.31) LMNATSHRGABRPGABRDGABRA1
SCHEMBL29282934 0.78 FOLH1 (0.48) ALDH1A1LMNATSHRGABRPGABRD
SCHEMBL19522729 0.75 GABRP (0.45) LMNATSHRGABRPGABRDGABRA1
SCHEMBL18477468 0.75 FOLH1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9801951-B2 Drug-conjugates, conjugation methods, and uses thereof CONCORTIS BIOSYSTEMS, CORP. (US) 2017-10-31 US disclosed
US-20170290925-A1 Conjugates And Conjugating Reagents POLYTHERICS LIMITED (GB) 2017-10-12 US disclosed
US-20170035903-A1 ANTIBODIES, ANTIBODY DRUG CONJUGATES AND METHODS OF USE EXELIXIS, INC. 2017-02-09 US disclosed
US-20160067350-A1 Drug-Conjugates, Conjugation Methods, and Uses Thereof Concortis Biosystems, Corp., a wholly owned Subsidiary of Sorrento Therapeutics, Inc. (US) 2016-03-10 US disclosed
US-20150141646-A1 Drug-Conjugates, Conjugation Methods, and Uses Thereof Concortis Biosystems, Corp., a wholly owned subsidary of Sorrento Therapeutics, Inc, (US) 2015-05-21 US disclosed
US-20150105539-A1 Drug-Conjugates, Conjugation Methods, and Uses Thereof Concortis Biosystems, Corp., a wholly owned Subsidiary of Sorrento Therapeutics, Inc. (US) 2015-04-16 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 (5 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-20170035903-A1 ANTIBODIES, ANTIBODY DRUG CONJUGATES AND METHODS OF USE GNRHR, FSHR, INHA ALDH1A1 228/4885LMNA 1629/4885SLC15A2 619/4885
US-20170290925-A1 Conjugates And Conjugating Reagents ANPEP, NGLY1, PCTP ALDH1A1 2594/4885LMNA 2300/4885SLC15A2 3794/4885
US-20160067350-A1 Drug-Conjugates, Conjugation Methods, and Uses Thereof PAICS, CES2, DNPEP ALDH1A1 160/4885LMNA 2439/4885SLC15A2 1251/4885
US-20150141646-A1 Drug-Conjugates, Conjugation Methods, and Uses Thereof ABCG2, UGT2B7, UGT1A9 ALDH1A1 154/4885LMNA 3456/4885SLC15A2 455/4885
US-20150105539-A1 Drug-Conjugates, Conjugation Methods, and Uses Thereof PAICS, CES2, DNPEP ALDH1A1 160/4885LMNA 2439/4885SLC15A2 1251/4885

“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.