SCHEMBL7962709

SCHEMBL7962709

C=C(CC(=O)OCCc1ccccc1)C(=O)OCCCN1CCCC1=O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 1/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
FFAR1 O14842 1/20 0.40
TYRO3 Q06418 2/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL7976401 0.94 POLB (0.46) KMT2AALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL7978959 0.92 SMN1; SMN2 (0.48) KMT2AALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL7976446 0.89 HTT (0.42) KMT2AALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL7974160 0.84 ALDH1A1 (0.45) KMT2AALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL7976393 0.81 SMN1; SMN2 (0.43) KMT2AALDH1A1SMN1; SMN2TSHRL3MBTL1
SCHEMBL8812410 0.80 TDP1 (0.54) ALDH1A1SMN1; SMN2TSHRLMNAL3MBTL1
SCHEMBL8092195 0.78 SMN1; SMN2 (0.40) KMT2AALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL22621360 0.77 TSHR (0.41) KMT2AALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL22615882 0.77 TSHR (0.41) KMT2AALDH1A1SMN1; SMN2POLBTSHR
SCHEMBL22615998 0.77 TSHR (0.41) KMT2AALDH1A1SMN1; SMN2POLBTSHR

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
US-6268511-B1 USED FOR PRODUCING COPOLYMER WITH ACRYLIC ESTER COMONOMERS; COPOLYMERS ARE USED FOR FOLDABLE INTRAOCULAR LENSES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-07-31 US disclosed
EP-0987247-A1 ITACONATE DERIVATIVES USED FOR A COMPONENT OF A POLYMER SANTEN PHARMACEUTICAL CO., LTD. (JP) 2000-03-22 EP disclosed