SCHEMBL16209910

SCHEMBL16209910

NC(=O)c1ccc(C(=O)Nc2ccc(F)cc2O)cn1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 1/20 0.51
▸ P4HTM Q9NXG6 6/20 0.50
▸ HDAC1 Q13547 3/20 0.48
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ HTT P42858 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ AHR P35869 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HDAC3 O15379 3/20 0.43
▸ HDAC2 Q92769 2/20 0.43
▸ NCOR2 Q9Y618 2/20 0.43

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
SCHEMBL16209386 0.91 CXCR2 (0.47) CXCR2P4HTMHDAC1NPC1RAB9A
SCHEMBL16209714 0.90 KCNMA1 (0.51) CXCR2P4HTMHDAC1NPC1RAB9A
SCHEMBL15019284 0.87 P4HTM (0.47) P4HTMNPC1RAB9ALMNAPOLB
SCHEMBL16209414 0.85 P4HTM (0.51) P4HTMNPC1RAB9ALMNAPOLB
SCHEMBL16209724 0.82 P4HTM (0.54) P4HTMHDAC1NPC1RAB9ALMNA
SCHEMBL16209638 0.81 KMT2A (0.48) CXCR2P4HTMNPC1RAB9AKDM4E
SCHEMBL15019683 0.81 P4HTM (0.56) P4HTMHDAC1NPC1RAB9ALMNA
SCHEMBL16209807 0.81 ALDH1A1 (0.42) P4HTMNPC1RAB9ALMNAPOLB
SCHEMBL16209413 0.81 KCNMA1 (0.52) P4HTMHDAC1NPC1MEN1AHR
SCHEMBL15019247 0.77 P4HTM (0.45) P4HTMNPC1RAB9ALMNAPOLB

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-20140329854-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL IN SIRTUIN BINDING AND MODULATION SMB INNOVATION (US) 2014-11-06 — — 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-20140329854-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL IN SIRTUIN BINDING AND MODULATION SIRT1, SIRT3, SIRT2 CXCR2 4421/4885P4HTM 2015/4885HDAC1 10/4885

“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