SCHEMBL16710134

SCHEMBL16710134

COc1ccc(CN(Cc2ccc3c(c2)OCO3)Cc2nc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)cs2)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD5 Q86SK9 1/20 0.49
TSHR P16473 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 5/20 0.43
HPGD P15428 1/20 0.43
GPR35 Q9HC97 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CCKAR P32238 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
BMP1 P13497 1/20 0.40
NPC1 O15118 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.40
MAPK1 P28482 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
ALOX15 P16050 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL16706801 0.93 ALDH1A1 (0.42) SCD5TSHRSMN1; SMN2MAPTHPGD
SCHEMBL16706794 0.92 SMN1; SMN2 (0.47) SCD5TSHRSMN1; SMN2MAPTHPGD
SCHEMBL16710103 0.91 SCD5 (0.47) SCD5TSHRSMN1; SMN2MAPTKMT2A
SCHEMBL18940991 0.91 ALDH1A1 (0.45) SCD5TSHRSMN1; SMN2MAPTHPGD
SCHEMBL16710137 0.89 MAPT (0.52) SCD5SMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL16710049 0.88 SMN1; SMN2 (0.49) SCD5TSHRSMN1; SMN2HPGDKMT2A
SCHEMBL16710119 0.87 SCD5 (0.46) SCD5TSHRSMN1; SMN2MAPTHPGD
SCHEMBL18939712 0.87 SMN1; SMN2 (0.55) TSHRSMN1; SMN2MAPTHPGDKMT2A
SCHEMBL18938818 0.87 SMN1; SMN2 (0.60) TSHRSMN1; SMN2HPGDKMT2AALDH1A1
SCHEMBL16706786 0.86 SMN1; SMN2 (0.47) TSHRSMN1; SMN2MAPTHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951033-B2 Tertiary amines for use in the treatment of cardiac disorders UNIVERSITETET I OSLO (NO) 2018-04-24 US disclosed
US-20170158657-A1 TERTIARY AMINES FOR USE IN THE TREATMENT OF CARDIAC DISORDERS UNIVERSITETET I OSLO (NO) 2017-06-08 US disclosed
US-9556111-B2 Tertiary amines for use in the treatment of cardiac disorders UNIVERSITETET I OSLO (NO) 2017-01-31 US disclosed
US-20150133510-A1 TERTIARY AMINES FOR USE IN THE TREATMENT OF CARDIAC DISORDERS UNIVERSITETET I OSLO (NO) 2015-05-14 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 (2 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-20170158657-A1 TERTIARY AMINES FOR USE IN THE TREATMENT OF CARDIAC DISORDERS TNNI3, TNNT2, MYLK2 SCD5 2633/4885TSHR 2005/4885SMN1; SMN2 2862/4885
US-20150133510-A1 TERTIARY AMINES FOR USE IN THE TREATMENT OF CARDIAC DISORDERS TNNI3, TNNT2, MYLK2 SCD5 2344/4885TSHR 2085/4885SMN1; SMN2 3065/4885

“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.