SCHEMBL19084220

SCHEMBL19084220

C=CCc1ccc(Oc2ccc(CC)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.62
ALDH1A1 P00352 5/20 0.62
CYP3A4 P08684 2/20 0.62
TP53 P04637 1/20 0.62
ALOX15 P16050 1/20 0.62
TSHR P16473 1/20 0.62
ALOX12 P18054 1/20 0.62
PPARG P37231 2/20 0.43
PPARD Q03181 2/20 0.43
PPARA Q07869 1/20 0.43
XDH P47989 1/20 0.42
MMP2 P08253 1/20 0.41
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
ALOX5 P09917 1/20 0.40
AR P10275 1/20 0.40
PTGS1 P23219 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
NPC1 O15118 1/20 0.39

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
SCHEMBL88416 0.89 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1CYP3A4TP53ALOX15
SCHEMBL9352993 0.89 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1CYP3A4TP53ALOX15
SCHEMBL2793675 0.87 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1CYP3A4TP53ALOX15
SCHEMBL3744646 0.87 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1CYP3A4TP53ALOX15
SCHEMBL4556361 0.87 ALDH1A1 (0.58) SMN1; SMN2ALDH1A1CYP3A4TP53ALOX15
SCHEMBL8925998 0.82 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1TP53MAPTHPGD
SCHEMBL475215 0.82 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1TP53MAPTHPGD
SCHEMBL5606838 0.82 TSHR (0.59) SMN1; SMN2ALDH1A1CYP3A4TP53ALOX15
SCHEMBL9504970 0.81 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1CYP3A4TP53ALOX15
SCHEMBL9062160 0.80 ST14 (0.61) SMN1; SMN2ALDH1A1CYP3A4TP53ALOX15

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-2017115978-A1 ORGANIC FILM COMPOSITION AND PATTERN FORMING METHOD 삼성에스디아이 주식회사 2017-07-06 WO disclosed