SCHEMBL19699103

SCHEMBL19699103

Cc1cccc(NC(=O)N2c3nc(-c4cncc(C(F)(F)F)c4)ccc3N3C[C@@H](O)[C@H]2C3)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.42
▸ SCN2A Q99250 2/20 0.36
▸ SCN10A Q9Y5Y9 2/20 0.36
▸ NPY5R Q15761 1/20 0.36
▸ FYN P06241 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ TRPV3 Q8NET8 1/20 0.35
▸ PI4KB Q9UBF8 1/20 0.34
▸ PAX8 Q06710 1/20 0.34
▸ ABL1 P00519 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ TSHR P16473 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
SCHEMBL17618834 0.92 SCN10A (0.41) MAPTSCN10ATRPV3ABL1
SCHEMBL17618846 0.89 HTR2C (0.44) MAPTMEN1KMT2AABL1
SCHEMBL17618819 0.88 PHGDH (0.42) MAPTSCN10AFYNMEN1KMT2A
SCHEMBL17618848 0.87 RHOA (0.44) MAPTFYNABL1
SCHEMBL17618836 0.86 ABL1 (0.38) SCN10ATRPV3ABL1
SCHEMBL17618841 0.84 PIK3CD (0.35) TRPV3ABL1
SCHEMBL17618839 0.83 TRPV1 (0.38) TRPV3ABL1
SCHEMBL17618844 0.83 GABRA1 (0.40) TRPV3ABL1
SCHEMBL17618814 0.83 HTR2C (0.46) MAPTFYNMEN1KMT2AABL1
SCHEMBL17618840 0.83 ALOX15 (0.37) MAPTTRPV3ABL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2020-03-17 — — US disclosed
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2017-12-14 — — US disclosed
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2017-12-14 — — 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-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 MAPT 267/4885SCN2A 4296/4885SCN10A 3878/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 MAPT 267/4885SCN2A 4296/4885SCN10A 3878/4885

“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.

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