SCHEMBL7994825

SCHEMBL7994825

[CH2]CC/C1=C/CCCCCC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
ALOX15 P16050 2/20 0.46
ALDH1A1 P00352 4/20 0.46
USP2 O75604 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
EPHX1 P07099 1/20 0.41
PKM P14618 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
CXCR3 P49682 1/20 0.40
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
ALOX12 P18054 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL7994828 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ALOX15ALDH1A1USP2NPSR1
SCHEMBL177599 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ALOX15ALDH1A1USP2NPSR1
SCHEMBL68780 0.98
SCHEMBL61666 0.91
SCHEMBL7991219 0.87 SMN1; SMN2 (0.44) SMN1; SMN2ALOX15ALDH1A1USP2NPSR1
SCHEMBL7991224 0.87 SMN1; SMN2 (0.44) SMN1; SMN2ALOX15ALDH1A1USP2NPSR1
SCHEMBL4325752 0.87 SMN1; SMN2 (0.44) SMN1; SMN2ALOX15ALDH1A1USP2NPSR1
SCHEMBL2513477 0.85 ALDH1A1 (0.52) SMN1; SMN2ALOX15ALDH1A1USP2NPSR1
SCHEMBL4337073 0.85 SMN1; SMN2 (0.42) SMN1; SMN2ALOX15ALDH1A1USP2NPSR1
SCHEMBL4337065 0.85 SMN1; SMN2 (0.42) SMN1; SMN2ALOX15ALDH1A1USP2NPSR1

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-6277790-B1 APPLYING PLANTS, SEEDS, SOILS OR ENVIRONMENT BASF AKTIENGESELLSCHAFT (DE) 2001-08-21 US disclosed