SCHEMBL25917913

SCHEMBL25917913

Cc1ccc(Oc2cccc(C(F)(F)F)c2)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK39 Q9UEW8 1/20 0.50
EGFR P00533 5/20 0.49
ERBB2 P04626 5/20 0.49
ERBB3 P21860 3/20 0.49
ERBB4 Q15303 3/20 0.49
NPSR1 Q6W5P4 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MAPT P10636 1/20 0.48
TEAD1 P28347 2/20 0.46
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ATM Q13315 1/20 0.43
HTR2A P28223 3/20 0.43
SLC6A4 P31645 3/20 0.43
KCNH2 Q12809 3/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 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
SCHEMBL7597428 0.88 L3MBTL1 (0.51) STK39EGFRERBB2ERBB3ERBB4
SCHEMBL25472566 0.85 TEAD1 (0.55) NPSR1L3MBTL1MAPTTEAD1HTR2A
SCHEMBL14586640 0.85 NPSR1 (0.50) NPSR1L3MBTL1MAPTTEAD1CYP1A2
SCHEMBL15832050 0.84 L3MBTL1 (0.60) STK39EGFRERBB2ERBB3ERBB4
SCHEMBL10538095 0.83 NPSR1 (0.57) STK39EGFRERBB2ERBB3ERBB4
SCHEMBL29638122 0.82 EGFR (0.53) STK39EGFRERBB2ERBB3ERBB4
SCHEMBL2747848 0.82 EGFR (0.53) STK39EGFRERBB2ERBB3ERBB4
SCHEMBL11121304 0.82 STK39 (0.50) STK39EGFRERBB2ERBB3ERBB4
SCHEMBL22225305 0.82 STK39 (0.47) STK39EGFRERBB2ERBB3ERBB4
SCHEMBL2749254 0.82 STK39 (0.58) STK39EGFRERBB2ERBB3ERBB4

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-3350181-B1 HER3 LIGANDS AND USES THEREOF UNIV CALIFORNIA (US) 2023-11-01 EP disclosed
WO-2023141635-A2 HER3 LIGANDS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-07-27 WO disclosed