SCHEMBL14505071

SCHEMBL14505071

C=C(C)C(=O)Oc1ccc(OC(=O)C2CCC3OC3C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.46
▸ ATM Q13315 2/20 0.46
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ ELANE P08246 3/20 0.43
▸ POLB P06746 2/20 0.35
▸ HPGD P15428 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ F2 P00734 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ TFPI2 P48307 1/20 0.31

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
SCHEMBL14817249 0.82 KMT2A (0.49) KMT2AATMHTTSMN1; SMN2TDP1
SCHEMBL26261372 0.80 ELANE (0.53) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL22261439 0.80 TDP1 (0.44) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL27986257 0.80 PPM1B (0.34) KDM4EALDH1A1TFPI2
SCHEMBL14533167 0.77 KMT2A (0.55) KMT2AATMHTTSMN1; SMN2TDP1
SCHEMBL18356937 0.76 KMT2A (0.40) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL15978734 0.76 HTT (0.40) KMT2AATMHTTSMN1; SMN2TDP1
SCHEMBL15978728 0.76 NPSR1 (0.46) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL17754259 0.76 KMT2A (0.49) KMT2AATMHTTSMN1; SMN2TDP1
SCHEMBL14817279 0.75 ELANE (0.45) KMT2AHTTSMN1; SMN2TDP1ELANE

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-7220530-B2 Light sensitive planographic printing plate material KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-22 — — US disclosed
Send feedback