SCHEMBL1719852

SCHEMBL1719852

C=CCSc1nnc(Sc2nccnc2C#N)s1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 5/20 0.34
TP53 P04637 1/20 0.34
RAB9A P51151 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DCUN1D1 Q96GG9 1/20 0.34
MAPT P10636 5/20 0.33
HTT P42858 1/20 0.33
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPC1 O15118 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
POLB P06746 1/20 0.31
MEN1 O00255 2/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL3996374 0.90 ALDH1A1 (0.32) TSHRALDH1A1TP53RAB9ATDP1
SCHEMBL1719815 0.82 ALDH1A1 (0.39) TSHRKMT2AALDH1A1TP53RAB9A
SCHEMBL1720086 0.80 SMN1; SMN2 (0.40) TSHRKMT2AALDH1A1TP53RAB9A
SCHEMBL6990637 0.80 TSHR (0.37) TSHRALDH1A1TP53RAB9AHPGD
SCHEMBL1719384 0.79 KMT2A (0.35) KMT2AALDH1A1RAB9AKDM4ENPC1
SCHEMBL1719442 0.77 MAPT (0.30) KMT2AMAPT
SCHEMBL1719407 0.77 ALDH1A1 (0.45) TSHRKMT2AALDH1A1TP53RAB9A
SCHEMBL3994258 0.76 ALDH1A1 (0.47) TSHRKMT2AALDH1A1TP53KDM4E
SCHEMBL1719652 0.75 MAPT (0.30) MAPT
SCHEMBL1719424 0.75 ICAM1 (0.40) ALDH1A1TP53RAB9AL3MBTL1DCUN1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130273024-A1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC (US) 2013-10-17 US claimed
EP-2452683-A2 Methods for treating atherosclerosis Amgen Inc. (US) 2012-05-16 EP claimed
EP-2037928-B1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC (US) 2012-01-11 EP claimed
US-20080096900-A1 Methods for treating atherosclerosis AMGEN INC. (US) 2008-04-24 US claimed
US-20130273024-A1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC (US) 2013-10-17 US disclosed
US-20130273024-A1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC (US) 2013-10-17 US disclosed
US-20130273024-A1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC (US) 2013-10-17 US disclosed
US-8426358-B2 Methods for treating atherosclerosis AMGEN INC. (US) 2013-04-23 US disclosed
US-8426358-B2 Methods for treating atherosclerosis AMGEN INC. (US) 2013-04-23 US disclosed
US-8426358-B2 Methods for treating atherosclerosis AMGEN INC. (US) 2013-04-23 US disclosed
EP-2452683-A2 Methods for treating atherosclerosis Amgen Inc. (US) 2012-05-16 EP disclosed
EP-2037928-B1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC (US) 2012-01-11 EP disclosed
US-20110206652-A1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC. (US) 2011-08-25 US disclosed
US-20110206652-A1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC. (US) 2011-08-25 US disclosed
US-20110206652-A1 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC. (US) 2011-08-25 US disclosed
EP-2037928-A2 METHODS FOR TREATING ATHEROSCLEROSIS Amgen Inc. (US) 2009-03-25 EP disclosed
US-20080096900-A1 Methods for treating atherosclerosis AMGEN INC. (US) 2008-04-24 US disclosed
US-20080096900-A1 Methods for treating atherosclerosis AMGEN INC. (US) 2008-04-24 US disclosed
US-20080096900-A1 Methods for treating atherosclerosis AMGEN INC. (US) 2008-04-24 US disclosed
WO-2008002591-A2 METHODS FOR TREATING ATHEROSCLEROSIS AMGEN INC (US) 2008-01-03 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-20130273024-A1 METHODS FOR TREATING ATHEROSCLEROSIS LCAT, PCSK9, CETP TSHR 2835/4885KMT2A 2382/4885ALDH1A1 2876/4885
US-20080096900-A1 Methods for treating atherosclerosis LCAT, PCSK9, CETP TSHR 2835/4885KMT2A 2382/4885ALDH1A1 2876/4885
US-20110206652-A1 METHODS FOR TREATING ATHEROSCLEROSIS LCAT, PCSK9, CETP TSHR 2835/4885KMT2A 2382/4885ALDH1A1 2876/4885

“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.