SCHEMBL7362044

SCHEMBL7362044

CC(C)C[C@H](NC(=O)OCC(O)CO)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
FOLH1 Q04609 8/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
MME P08473 5/20 0.48
MAPT P10636 1/20 0.46
LAP3 P28838 3/20 0.45
TYR P14679 1/20 0.45

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
SCHEMBL7362042 1.00 ALDH1A1 (0.51) ALDH1A1FOLH1MEN1LMNAKMT2A
SCHEMBL7365213 0.87 TAS1R3 (0.46) FOLH1MME
SCHEMBL7365210 0.87 TAS1R3 (0.46) FOLH1MME
SCHEMBL18190834 0.86 ALDH1A1 (0.58) ALDH1A1FOLH1MEN1LMNAKMT2A
SCHEMBL19651554 0.84 CTSK (0.42) ALDH1A1MEN1LMNAKMT2AMME
SCHEMBL19651560 0.83 SMN1; SMN2 (0.44) MEN1LMNAKMT2AMME
SCHEMBL19651549 0.81 KDM4E (0.41) MEN1LMNAKMT2AMME
SCHEMBL9830039 0.80 ALDH1A1 (0.58) ALDH1A1FOLH1MEN1LMNAKMT2A
SCHEMBL2234720 0.80 MME (0.53) ALDH1A1FOLH1MEN1LMNAKMT2A
SCHEMBL2234718 0.80 MME (0.53) ALDH1A1FOLH1MEN1LMNAKMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0415981-A4 RETROVIRAL PROTEASE INHIBITORS 1991-10-09 EP disclosed
EP-0415981-A1 RETROVIRAL PROTEASE INHIBITORS ABBOTT LABORATORIES (US) 1991-03-13 EP disclosed
EP-0342541-A2 Retroviral protease inhibitors ABBOTT LABORATORIES (US) 1989-11-23 EP disclosed
WO-1989010752-A1 RETROVIRAL PROTEASE INHIBITORS ABBOTT LABORATORIES (US) 1989-11-16 WO disclosed