SCHEMBL16785642

SCHEMBL16785642

Cc1cncc(NC(=O)N2CCCCNc3ccc(N4CCCC(C(F)(F)F)C4)nc32)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 2/20 0.40
▸ PRMT5 O14744 11/20 0.39
▸ WDR77 Q9BQA1 11/20 0.39
▸ TRPV3 Q8NET8 1/20 0.39
▸ DGAT2 Q96PD7 1/20 0.38
▸ EIF2AK4 Q9P2K8 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ MAP4K4 O95819 1/20 0.35
▸ AR P10275 1/20 0.34

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
SCHEMBL16785570 0.98 TRPV3 (0.39) SCN10APRMT5WDR77TRPV3DGAT2
SCHEMBL16785571 0.92 TRPV3 (0.39) SCN10ATRPV3DGAT2EIF2AK4KMT2A
SCHEMBL16785636 0.92 SCN10A (0.42) SCN10ATRPV3DGAT2EIF2AK4MAP4K4
SCHEMBL16785631 0.90 TRPV3 (0.39) SCN10ATRPV3DGAT2EIF2AK4KMT2A
SCHEMBL16785539 0.90 TRPV3 (0.41) SCN10ATRPV3EIF2AK4KMT2AMAP4K4
SCHEMBL16785543 0.89 HTR2C (0.39) TRPV3EIF2AK4KMT2AMAP4K4
SCHEMBL16785645 0.89 TRPV3 (0.40) SCN10ATRPV3DGAT2EIF2AK4KMT2A
SCHEMBL16785633 0.86 HTR2C (0.39) TRPV3EIF2AK4KMT2AMAP4K4
SCHEMBL16785653 0.85 MAP4K4 (0.37) SCN10ATRPV3EIF2AK4KMT2AMAP4K4
SCHEMBL16785635 0.85 TRPV1 (0.40) TRPV3EIF2AK4MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150152108-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2015-06-04 — — 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-20150152108-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 SCN10A 3878/4885PRMT5 209/4885WDR77 1434/4885

“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.

Send feedback