SCHEMBL1067699

SCHEMBL1067699

CCCCCCC(=O)NCCc1cn(O)c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.60
EPHX2 P34913 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TRPV1 Q8NER1 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
OXER1 Q8TDS5 1/20 0.48
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL1068332 1.00 MTNR1A (0.60) MTNR1AEPHX2MEN1KMT2ATRPV1
SCHEMBL1064566 0.95 MTNR1A (0.58) MTNR1AMEN1KMT2ASMN1; SMN2
SCHEMBL20648045 0.88 KMT2A (0.65) MTNR1AMEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL1082713 0.80 SIGMAR1 (0.49) OXER1
SCHEMBL3667836 0.79 MEN1 (0.52) MTNR1AMEN1KMT2A
SCHEMBL13973212 0.79 KMT2A (0.59) MEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL12017348 0.77 MEN1 (0.46) MTNR1AMEN1KMT2A
SCHEMBL17943476 0.77 POLB (0.58) MTNR1AMEN1KMT2A
SCHEMBL22411433 0.75 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1
SCHEMBL1727281 0.75 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7872040-B2 Receptor blocker and vasodilator comprising indole derivative as active ingredient SOMEI MASANORI 2011-01-18 US disclosed
US-20090005430-A1 Receptor Blocker and Vasodilator Comprising Indole Derivative as Active Ingredient NATIONAL UNIVERSITY CORPORATION KANAZAWA UNIVERSITY (JP) 2009-01-01 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 (1 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-20090005430-A1 Receptor Blocker and Vasodilator Comprising Indole Derivative as Active Ingredient ADRB2, ADRB1, ADRA2B MTNR1A 261/4885EPHX2 2985/4885MEN1 3707/4885

“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.