SCHEMBL18347692

SCHEMBL18347692

CC(C)(C)C(=O)Nc1ccc(OCc2ccccc2)c2ncccc12

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 1/20 0.51
TOP2A P11388 1/20 0.47
PPIA P62937 8/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
BRD4 O60885 1/20 0.44
RPS6KB1 P23443 1/20 0.44
SGMS2 Q8NHU3 1/20 0.42
PKM P14618 1/20 0.41
PDE4D Q08499 1/20 0.41
HDAC6 Q9UBN7 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
SCHEMBL20554145 0.82 SLC40A1 (0.51) SLC40A1PPIASMN1; SMN2BRD4RPS6KB1
SCHEMBL18347805 0.78 SLC40A1 (0.43) SLC40A1PPIABRD4SGMS2
SCHEMBL16878631 0.77 MAPT (0.45) PPIASMN1; SMN2PKM
SCHEMBL8110769 0.76 KMT2A (0.49) SLC40A1SMN1; SMN2HDAC6
SCHEMBL16887761 0.76 HTT (0.61) TOP2ASMN1; SMN2PDE4D
SCHEMBL3307110 0.76 MAPT (0.56) SLC40A1PPIASMN1; SMN2SGMS2PDE4D
SCHEMBL23360351 0.74 PRMT5 (0.51) BRD4
SCHEMBL8025399 0.74 TOP2A (0.51) TOP2ASMN1; SMN2PDE4D
SCHEMBL16407670 0.73 PSMD14 (0.53) SLC40A1SMN1; SMN2
SCHEMBL29259247 0.73 MAPT (0.47) SLC40A1SMN1; SMN2PDE4DHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10766882-B2 1,2-naphthoquinone based derivative and method of preparing the same YUNGJIN PHARM CO., LTD. (KR) 2020-09-08 US disclosed
US-9975883-B2 1,2-naphthoquinone based derivative and method of preparing the same YUNGJIN PHARM. CO., LTD. (KR) 2018-05-22 US disclosed
US-9975883-B2 1,2-naphthoquinone based derivative and method of preparing the same YUNGJIN PHARM. CO., LTD. (KR) 2018-05-22 US disclosed
US-20160376258-A1 1,2-NAPHTHOQUINONE BASED DERIVATIVE AND METHOD OF PREPARING THE SAME KT&G LIFE SCIENCES CORPORATION (KR) 2016-12-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10766882-B2 1,2-naphthoquinone based derivative and method of preparing the same CYP2S1, GYS2, SLC5A1 SLC40A1 1868/4885TOP2A 846/4885PPIA 3413/4885
US-20160376258-A1 1,2-NAPHTHOQUINONE BASED DERIVATIVE AND METHOD OF PREPARING THE SAME CYP2S1, GYS2, SLC5A1 SLC40A1 1868/4885TOP2A 846/4885PPIA 3413/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.