SCHEMBL11090159

SCHEMBL11090159

CC(C)(C)c1cc(N2C(=O)N(C(C)(C)C)CC2O)no1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.46
ALOX15 P16050 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.40
EGFR P00533 3/20 0.35
CNR2 P34972 10/20 0.34
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR1 P21554 6/20 0.33
EPHX2 P34913 2/20 0.33
FLT3 P36888 1/20 0.32

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
SCHEMBL8378260 0.85 HTR7 (0.47) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL11078392 0.82 HTR7 (0.45) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL11041935 0.81 HTR7 (0.44) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL11016899 0.80 ALOX15 (0.46) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL17736981 0.78 HTR7 (0.42) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL11296309 0.78 ALOX15 (0.42) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL22572570 0.78 HTR7 (0.46) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL22572627 0.77 HTR7 (0.45) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL17736995 0.76 HTR7 (0.39) HTR7ALOX15MEN1KMT2AALDH1A1
SCHEMBL17736739 0.76 HTR7 (0.41) HTR7ALOX15MEN1KMT2AALDH1A1

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-0124342-A2 Process for preparing isoxazolyl imidazolidinones ELI LILLY AND COMPANY (US) 1984-11-07 EP claimed
EP-0124342-A2 Process for preparing isoxazolyl imidazolidinones ELI LILLY AND COMPANY (US) 1984-11-07 EP disclosed