SCHEMBL11528798

SCHEMBL11528798

C[C@]1([C@@H](O)c2ccccc2)C(=O)OC[C@@H]1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 1/20 0.35
PTBP1 P26599 1/20 0.34
ALDH1A1 P00352 3/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KMT2A Q03164 1/20 0.33
SRC P12931 1/20 0.33
CYP2D6 P10635 1/20 0.33
NR1I2 O75469 1/20 0.33
ABCB11 O95342 1/20 0.33
GLA P06280 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
RECQL P46063 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 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
SCHEMBL10788080 0.67 CYP2C9 (0.40) LMNAHPGDPTBP1ALDH1A1CYP1A2
SCHEMBL10788109 0.65 ALDH1A1 (0.38) LMNAHPGDPTBP1ALDH1A1HTT
SCHEMBL22504186 0.62 SLC1A2 (0.30)
SCHEMBL22558757 0.61 LMNA (0.41) LMNAMAPK1ALDH1A1SRCCYP2D6
Camphoric Acid SCHEMBL31154319 0.61 NPSR1 (0.50) LMNAMAPK1ALDH1A1HTTNPSR1
SCHEMBL31618321 0.61 ALDH1A1 (0.38) LMNAMAPK1HPGDALDH1A1SRC
SCHEMBL19809411 0.60 LMNA (0.39) LMNAMAPK1ALDH1A1KMT2ASRC
SCHEMBL15106438 0.59 SRC (0.46) LMNAMAPK1HPGDALDH1A1KMT2A
SCHEMBL1312762 0.58 SRC (0.64) LMNAMAPK1HPGDALDH1A1KMT2A
SCHEMBL23375795 0.57 LMNA (0.49) LMNAALDH1A1HTTKMT2ASMN1; SMN2

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-4145437-A LACTONES, ANTIULCER AGENTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-03-20 US disclosed