SCHEMBL9259862

SCHEMBL9259862

C=CCN(CC=C)C(=C)COC(=O)OCC(=C)N(CC=C)CC=C

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL2489450 0.78 ALDH1A1 (0.38) ALDH1A1
SCHEMBL16500488 0.73 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL7155920 0.69 CHRNB2 (0.38) ALDH1A1
SCHEMBL11442766 0.68 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL3360577 0.67 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2
SCHEMBL10645801 0.67 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL2641242 0.67 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6827624 0.67 TDP1 (0.40) ALDH1A1MAPT
SCHEMBL569156 0.66 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL13786 0.66 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0476785-B1 Processes for the preparation of aminoethers OSI SPECIALTIES INC (US) 1995-12-06 EP claimed
US-5214142-A PROCESSES FOR THE PREPARATION OF AMINOETHERS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-25 US claimed
EP-0476785-A1 Processes for the preparation of aminoethers OSi Specialties, Inc. (US) 1992-03-25 EP claimed
EP-0476785-B1 Processes for the preparation of aminoethers OSI SPECIALTIES INC (US) 1995-12-06 EP disclosed
EP-0640388-A1 Magnesium/aluminum mixed oxide catalysts and their use in the production of aminoethers UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1995-03-01 EP disclosed
US-5214142-A PROCESSES FOR THE PREPARATION OF AMINOETHERS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-25 US disclosed
EP-0476785-A1 Processes for the preparation of aminoethers OSi Specialties, Inc. (US) 1992-03-25 EP disclosed