SCHEMBL9061850

SCHEMBL9061850

CCCCCCCCCCC(O)Oc1ccc(C(N)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 5/20 0.53
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
APAF1 O14727 1/20 0.47
RGS12 O14924 1/20 0.47
HSP90AA1 P07900 1/20 0.47
MAPK1 P28482 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PARP4 Q9UKK3 2/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
PARP1 P09874 1/20 0.45
PARP2 Q9UGN5 1/20 0.45
TP53 P04637 2/20 0.44
TSHR P16473 1/20 0.44
PLA2G4B P0C869 2/20 0.44
ALDH1A1 P00352 1/20 0.43
PARP15 Q460N3 1/20 0.43

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
SCHEMBL9061631 0.87 TP53 (0.60) KMT2AMEN1TP53TSHRPLA2G4B
SCHEMBL3626125 0.85 TP53 (0.58) KMT2AMAPK1TP53TSHRPLA2G4B
SCHEMBL9058979 0.84 PARP10 (0.51) PARP10KMT2AMEN1APAF1RGS12
SCHEMBL10295292 0.84 MGLL (0.56) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL27868074 0.83 ELANE (0.49) MAPK1RAB9ASMN1; SMN2TP53TSHR
SCHEMBL6261663 0.83 RARB (0.63) KMT2AMEN1TP53TSHRPLA2G4B
SCHEMBL18264279 0.83 ELANE (0.49) MAPK1RAB9ASMN1; SMN2TP53TSHR
SCHEMBL8925288 0.83 ELANE (0.49) MAPK1RAB9ASMN1; SMN2TP53TSHR
SCHEMBL6827554 0.82 TSHR (0.45) MAPK1SMN1; SMN2TP53TSHRPLA2G4B
SCHEMBL28112451 0.80 PARP10 (0.57) PARP10KMT2AMEN1APAF1RGS12

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-1996017589-A1 METHOD OF SMOOTHING OR REMOVING WRINKLES AND METHOD OF STIMULATING COLLAGEN SYNTHESIS KAO CORPORATION (JP) 1996-06-13 WO disclosed