SCHEMBL9979277

SCHEMBL9979277

O=C(O)CC(C(=O)O)C(CC(=O)Nc1cccc2ccc3cc4ccccc4cc3c12)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
TSHR P16473 1/20 0.39
KDM4E B2RXH2 2/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 3/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
GAA P10253 2/20 0.38
RAB9A P51151 1/20 0.38
SIRT5 Q9NXA8 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36

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
SCHEMBL2555596 0.78 KDM4E (0.47) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL31310497 0.75 KDM4E (0.57) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL5907677 0.70 SMN1; SMN2 (0.50) ALDH1A1MEN1KMT2ATSHRKDM4E
SCHEMBL9815043 0.70 CYP1A2 (0.57) ALDH1A1MEN1KMT2ATSHRKDM4E
SCHEMBL31206278 0.68 ALDH1A1 (0.77) ALDH1A1MEN1KMT2ATSHRKDM4E
SCHEMBL776464 0.67 SMN1; SMN2 (0.59) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL15845110 0.66 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ATSHRKDM4E
SCHEMBL9815029 0.66 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ATSHRKDM4E
SCHEMBL16794736 0.65 ALDH1A1 (0.45) ALDH1A1MEN1KMT2ATSHRKDM4E
SCHEMBL8655906 0.65 KDM4E (0.62) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492468-B2 Polypropylene resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-23 US disclosed
US-20110301268-A1 POLYPROPYLENE RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-08 US disclosed