SCHEMBL26070969

SCHEMBL26070969

Nc1[nH]nnc1-c1cccc(OCc2ccc(-c3ccco3)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.43
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
PPARG P37231 1/20 0.40
KMT2A Q03164 1/20 0.40
NCOA2 Q15596 1/20 0.40
NCOA1 Q15788 1/20 0.40
PIK3CD O00329 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39
PRKDC P78527 1/20 0.39
IGF1R P08069 1/20 0.38
APP P05067 1/20 0.36
HPGD P15428 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAOB P27338 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL18006363 0.85 NAAA (0.39) TAAR1ALDH1A1KDM4EMAPTMEN1
SCHEMBL26070984 0.83 IGF1R (0.42) ALDH1A1KDM4EMAPTMEN1PPARG
SCHEMBL26071045 0.82 MRGPRX4 (0.45) ALDH1A1KDM4EMAPTMEN1PPARG
SCHEMBL26070912 0.79 IGF1R (0.45) ALDH1A1KDM4EMAPTMEN1PPARG
SCHEMBL26071031 0.78 PIK3CD (0.39) ALDH1A1KDM4EMAPTMEN1PPARG
SCHEMBL26071092 0.78 IGF1R (0.39) ALDH1A1KDM4EMAPTMEN1PPARG
SCHEMBL26071079 0.76 IGF1R (0.35) ALDH1A1KDM4EMAPTMEN1PPARG
SCHEMBL26070982 0.76 HTR1B (0.41) ALDH1A1KDM4EMAPTMEN1PPARG
SCHEMBL26071035 0.75 CYP4F2 (0.46) MAOB
SCHEMBL26070568 0.74 MEN1 (0.47) KDM4EMAPTMEN1KMT2APIK3CD

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
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 EP disclosed