SCHEMBL9004492

SCHEMBL9004492

C=CCCCCCCCCC(=O)Oc1ccc(C=O)cc1

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.77
ALDH1A1 P00352 4/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 2/20 0.42
ABCC4 O15439 1/20 0.42
EGFR P00533 3/20 0.42
ERBB2 P04626 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
HPGD P15428 3/20 0.39
RET P07949 1/20 0.37

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
SCHEMBL14575820 0.87 KMT2A (1.00) KMT2AALDH1A1LMNAMAPTEGFR
SCHEMBL14575315 0.84 KMT2A (0.93) KMT2AALDH1A1LMNAMAPTEGFR
SCHEMBL28158388 0.84 LMNA (0.54) KMT2AALDH1A1LMNAMAPTABCC4
SCHEMBL28835276 0.84 KMT2A (0.51) KMT2AALDH1A1LMNAMAPTABCC4
SCHEMBL9879360 0.84 KMT2A (0.51) KMT2AALDH1A1LMNAMAPTABCC4
SCHEMBL24565376 0.83 PRSS1 (0.56) KMT2AALDH1A1LMNAMAPTABCC4
SCHEMBL7587172 0.83 PRSS1 (0.56) KMT2AALDH1A1LMNAMAPTABCC4
SCHEMBL4646697 0.83 KMT2A (0.83) KMT2AALDH1A1LMNAMAPTEGFR
SCHEMBL38652113 0.82 KMT2A (0.51) KMT2AALDH1A1MAPT
SCHEMBL1665845 0.82 KMT2A (0.81) KMT2AALDH1A1LMNAMAPTEGFR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442097-B1 Poly(arylenevinylene siloxanes) CONSORTIUM ELEKTROCHEM IND (DE) 1996-10-09 EP disclosed
US-5185419-A POLY(ARYLENEVINYLENESILOXANES) COMPOUNDS CONSORTIUM FUR ELEKTROCHEMISCHE GMBH (DE) 1993-02-09 US disclosed
EP-0442097-A2 Poly(arylenevinylene siloxanes) Consortium für elektrochemische Industrie GmbH (DE) 1991-08-21 EP disclosed