SCHEMBL18333386

SCHEMBL18333386

O=Cc1ccc(OC(=O)CCC(=O)OCCO)cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.66
ALDH1A1 P00352 5/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
EGFR P00533 4/20 0.41
ERBB2 P04626 4/20 0.41
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.38
PARP10 Q53GL7 1/20 0.38
PARP3 Q9Y6F1 1/20 0.38
CYP2A6 P11509 1/20 0.38
MGLL Q99685 1/20 0.36
LTA4H P09960 1/20 0.35

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
SCHEMBL13481050 0.87 KMT2A (0.85) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL15425249 0.86 KMT2A (0.64) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL4646026 0.85 KMT2A (0.77) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL4643895 0.82 KMT2A (0.83) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL4641512 0.81 KMT2A (0.87) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL28876412 0.80 ALDH1A1 (0.52) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL14575820 0.80 KMT2A (1.00) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL14575315 0.80 KMT2A (0.93) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL14513471 0.79 KMT2A (0.72) KMT2AALDH1A1MAPTLMNAHTT
SCHEMBL4642075 0.78 KMT2A (0.70) KMT2AALDH1A1MAPTLMNAHTT

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-3112930-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC Corporation (JP) 2017-01-04 EP disclosed
US-20160370626-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2016-12-22 US disclosed