SCHEMBL19786788

SCHEMBL19786788

CC(C)c1ccc(NNc2ccc(N(C)C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.46
ALOX15 P16050 3/20 0.46
HSD17B10 Q99714 2/20 0.46
TSHR P16473 2/20 0.46
KDM1A O60341 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
LMNA P02545 2/20 0.44
TDP1 Q9NUW8 3/20 0.43
MAPK1 P28482 2/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
GAA P10253 5/20 0.42
HPGD P15428 2/20 0.42
ALOX12 P18054 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.41
SLC2A1 P11166 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41

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
SCHEMBL346292 0.87 ALDH1A1 (0.61) ALDH1A1ALOX15HSD17B10TSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL2861214 0.84 ALDH1A1 (0.58) ALDH1A1ALOX15HSD17B10TSHRSMN1; SMN2
SCHEMBL28833363 0.84 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2LMNAGAAHPGD
SCHEMBL14188099 0.80 ALDH1A1 (0.52) ALDH1A1ALOX15HSD17B10TSHRSMN1; SMN2
SCHEMBL13172474 0.80 SLC2A1 (0.61) ALDH1A1ALOX15HSD17B10TSHRTDP1
SCHEMBL19648847 0.78 ALDH1A1 (0.73) ALDH1A1ALOX15HSD17B10TSHRKDM1A
SCHEMBL22548827 0.78 SMN1; SMN2 (0.41) ALDH1A1ALOX15HSD17B10TSHRKDM1A
SCHEMBL854384 0.78 CA1 (0.57) ALDH1A1ALOX15TSHRSMN1; SMN2LMNA
SCHEMBL21146822 0.75 SLC2A1 (0.55) ALDH1A1ALOX15HSD17B10TSHRLMNA
SCHEMBL2682782 0.75 ALDH1A1 (0.61) ALDH1A1ALOX15HSD17B10TSHRTDP1

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
WO-2018013999-A1 NON-NUCLEOSIDIC SOLID SUPPORTS AND PHOSPHORAMIDITE BUILDING BLOCKS FOR OLIGONUCLEOTIDE SYNTHESIS AM CHEMICALS LLC (US) 2018-01-18 WO disclosed