SCHEMBL9150443

SCHEMBL9150443

C=C(C)C(=O)N(C)c1ccccc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 4/20 0.46
MAPT P10636 2/20 0.46
GAA P10253 2/20 0.46
POLB P06746 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
HPGD P15428 2/20 0.46
LMNA P02545 1/20 0.46
GLA P06280 1/20 0.46
PTPN1 P18031 7/20 0.44
ALOX15 P16050 1/20 0.43
TSHR P16473 3/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA4 P22748 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41

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
SCHEMBL28353095 0.82 KMT2A (0.55) ALDH1A1KDM4EMAPTGAAPOLB
SCHEMBL3930397 0.82 TSPO (0.54) ALDH1A1KDM4EMAPTGAAPOLB
Methacrylic Acid SCHEMBL22042325 0.81 ALDH1A1 (0.58) ALDH1A1KDM4EMAPTGAAPOLB
SCHEMBL9068711 0.80 PTPN1 (0.49) ALDH1A1PTPN1ALOX15CA12CA1
SCHEMBL1046327 0.80 ALDH1A1 (0.52) ALDH1A1KDM4EMAPTGAAPOLB
SCHEMBL28250163 0.79 SIGMAR1 (0.44) ALDH1A1KDM4ELMNA
SCHEMBL11315869 0.78 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTGAAPOLB
SCHEMBL28147702 0.78 TSPO (0.47) ALDH1A1KDM4EMAPTPOLBHPGD
SCHEMBL14409180 0.78 PTPN1 (0.44) ALDH1A1KDM4ETDP1HPGDPTPN1
SCHEMBL28499158 0.77 GAA (0.36) ALDH1A1KDM4EMAPTGAAHPGD

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-5466357-A THERMOPLASTIC MATRIX PREPREG COMPOSITE PRODUCT THE UNIVERSITY OF CONNECTICUT (US) 1995-11-14 US disclosed