Sugi Predict

Sugi Predict / Compounds / SCHEMBL16449409

SCHEMBL16449409

SCHEMBL16449409

NC(N)c1ccc(O)cc1O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.50
▸ TYR P14679 2/20 0.48
▸ CES2 O00748 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALOX5 P09917 1/20 0.38

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
SCHEMBL22503911 0.81 TYR (0.55) ESR1TYR
SCHEMBL28642768 0.79 TYR (0.52) ESR1TYRCES2
SCHEMBL11522545 0.78 ESR1 (0.44) ESR1TYRCES2MEN1CYP1A2
SCHEMBL22278955 0.77 TYR (0.50) ESR1TYRCES2
SCHEMBL8577488 0.77 TYR (0.50) ESR1TYRCES2
SCHEMBL11018237 0.76 MEN1 (0.62) ESR1TYRCES2MEN1CYP1A2
SCHEMBL383417 0.75 LMNA (0.64) TYRCYP1A2CYP3A4
SCHEMBL31546086 0.75 TYR (0.59) TYR
SCHEMBL29446964 0.75 LMNA (0.64) TYRCYP1A2CYP3A4
SCHEMBL51618 0.75 TYR (0.70) ESR1TYR

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
EP-2835368-B1 Process for Isolation of Monophenolic-Bisaryl Triazines CYTEC TECH CORP (US) 2017-11-15 — — EP disclosed
EP-2835368-A1 Process for Isolation of Monophenolic-Bisaryl Triazines CYTEC TECHNOLOGY CORP. (US) 2015-02-11 — — EP disclosed