SCHEMBL8038289

SCHEMBL8038289

COC(=O)c1ccccc1NC(=O)Cc1ccc(Oc2ccc(OC3CCCCCCCCCCC3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
KDM4E B2RXH2 6/20 0.50
HSD17B10 Q99714 3/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
PDE5A O76074 1/20 0.49
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
ALOX12 P18054 1/20 0.47
TSHR P16473 2/20 0.47
RECQL P46063 1/20 0.47
MAPK10 P53779 2/20 0.46
KCNQ2 O43526 1/20 0.46
MAPK8 P45983 1/20 0.46
MAPK9 P45984 1/20 0.46
TP53 P04637 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
SCHEMBL6406657 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EHSD17B10KMT2ASMN1; SMN2
SCHEMBL8037922 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EHSD17B10KMT2ASMN1; SMN2
SCHEMBL8037885 0.99 KMT2A (0.51) ALDH1A1KDM4EHSD17B10KMT2ASMN1; SMN2
SCHEMBL8037911 0.91 ALDH1A1 (0.53) ALDH1A1KDM4EHSD17B10KMT2ASMN1; SMN2
SCHEMBL6338308 0.90 KMT2A (0.48) ALDH1A1KDM4EHSD17B10KMT2ASMN1; SMN2
SCHEMBL6338311 0.90 KMT2A (0.48) ALDH1A1KDM4EHSD17B10KMT2ASMN1; SMN2
SCHEMBL6339214 0.90 KMT2A (0.48) ALDH1A1KDM4EHSD17B10KMT2ASMN1; SMN2
SCHEMBL8038299 0.89 ALDH1A1 (0.50) ALDH1A1KDM4EKMT2ASMN1; SMN2GAA
SCHEMBL6405105 0.89 ALDH1A1 (0.50) ALDH1A1KDM4EKMT2ASMN1; SMN2GAA
SCHEMBL8039539 0.89 ALDH1A1 (0.50) ALDH1A1KDM4EKMT2ASMN1; SMN2GAA

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
EP-0806412-B1 BENZENE DERIVATIVES TEIJIN LTD (JP) 2000-04-05 EP disclosed