Sugi Predict

Sugi Predict / Compounds / SCHEMBL29323782

SCHEMBL29323782

SCHEMBL29323782

N#Cc1c(-c2cc(C(F)(F)F)nc(C(F)(F)F)c2)c(=O)c2cc3c(=O)c(-c4cc(C(F)(F)F)nc(C(F)(F)F)c4)c(C#N)c3c(F)c12

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ALPL P05186 1/20 0.32
▸ ALPI P09923 1/20 0.32
▸ GLA P06280 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ LMNA P02545 1/20 0.30

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
SCHEMBL29323058 0.76 KIF11 (0.49) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL29317473 0.75 AR (0.50) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL24541658 0.73 AR (0.45) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL24599532 0.72 AR (0.36) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL29331704 0.69 KMT2A (0.34) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL21082923 0.68 ALDH1A1 (0.35) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL29323655 0.67 AR (0.52) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL29331647 0.65 ALDH1A1 (0.41) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL29331618 0.63 KIF11 (0.52) ALDH1A1GAAKDM4EMAPTHTT
SCHEMBL29331685 0.63 KIF11 (0.52) ALDH1A1GAAKDM4EMAPTHTT

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-20240244874-A1 ORGANIC ELECTRONIC ELEMENT AND DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2024-07-18 — — US disclosed