SCHEMBL15526464

SCHEMBL15526464

CCCC(CCC)COc1cccc([C@H](N)CCO)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SCN4A P35499 2/20 0.40
CFD P00746 1/20 0.39
TPSB2 P20231 1/20 0.39
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL3702329 0.88 TSHR (0.46) KMT2ASMN1; SMN2SCN4ACFDTPSB2
SCHEMBL3967907 0.82 TSHR (0.52) KMT2ASMN1; SMN2TSHRMAPK1HIF1A
SCHEMBL20483108 0.82 MAPK1 (0.43) KMT2ASMN1; SMN2TSHRMAPK1HIF1A
SCHEMBL4568763 0.80 MAPK1 (0.50) KMT2ASMN1; SMN2TSHRMAPK1HIF1A
SCHEMBL4568972 0.80 MAPK1 (0.50) KMT2ASMN1; SMN2TSHRMAPK1HIF1A
SCHEMBL4568971 0.80 MAPK1 (0.50) KMT2ASMN1; SMN2TSHRMAPK1HIF1A
SCHEMBL3967162 0.80 ALDH1A1 (0.47) KMT2ASMN1; SMN2SCN4ACFDTPSB2
SCHEMBL3972726 0.80 SCN4A (0.47) KMT2ASMN1; SMN2SCN4ACFDTPSB2
SCHEMBL20332600 0.79 HIF1A (0.39) KMT2ASMN1; SMN2TSHRMAPK1HIF1A
SCHEMBL3972169 0.79 SMN1; SMN2 (0.45) KMT2ASMN1; SMN2CFDTPSB2TSHR

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-2844636-A2 METHODS FOR THE TREATMENT OF DIABETIC RETINOPATHY AND OTHER OPHTHALMIC DISEASES Acucela, Inc. (US) 2015-03-11 EP disclosed
WO-2013166449-A2 METHODS FOR THE TREATMENT OF DIABETIC RETINOPATHY AND OTHER OPHTHALMIC DISEASES ACUCELA INC. (US) 2013-11-07 WO disclosed