SCHEMBL16710040

SCHEMBL16710040

COc1ccc(CN(Cc2ccc3c(c2)OCO3)Cc2nc(C(=O)N3CCC(Cc4ccccc4)CC3)cs2)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 2/20 0.48
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
NPC1 O15118 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPK14 Q16539 1/20 0.41
POLB P06746 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
MGLL Q99685 1/20 0.41
MCHR1 Q99705 3/20 0.41
SCD5 Q86SK9 1/20 0.40
LMNA P02545 1/20 0.40
TRPC3 Q13507 1/20 0.39
TRPC6 Q9Y210 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
SCHEMBL16706814 0.92 BMP1 (0.46) BMP1KMT2AMEN1NPC1SMN1; SMN2
SCHEMBL18939712 0.89 SMN1; SMN2 (0.55) BMP1KMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL16710049 0.89 SMN1; SMN2 (0.49) BMP1KMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL16710137 0.87 MAPT (0.52) KMT2AMEN1NPC1SMN1; SMN2CYP2C9
SCHEMBL18938818 0.86 SMN1; SMN2 (0.60) KMT2AMEN1SMN1; SMN2POLBKDM4E
SCHEMBL18940991 0.86 ALDH1A1 (0.45) BMP1KMT2AMEN1NPC1SMN1; SMN2
SCHEMBL16706786 0.85 SMN1; SMN2 (0.47) BMP1KMT2AMEN1NPC1SMN1; SMN2
SCHEMBL16706794 0.85 SMN1; SMN2 (0.47) BMP1KMT2AMEN1SMN1; SMN2POLB
SCHEMBL18940130 0.85 SMN1; SMN2 (0.47) KMT2AMEN1SMN1; SMN2KDM4EALDH1A1
SCHEMBL16710119 0.85 SCD5 (0.46) KMT2AMEN1SMN1; SMN2POLBKDM4E

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 BMP1 3708/4885KMT2A 976/4885MEN1 3450/4885
US-20150133510-A1 TERTIARY AMINES FOR USE IN THE TREATMENT OF CARDIAC DISORDERS TNNI3, TNNT2, MYLK2 BMP1 3826/4885KMT2A 904/4885MEN1 3518/4885

“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.