SCHEMBL10148398

SCHEMBL10148398

O=C(O)c1ccc2c(C3CC3)cccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.58
CREBBP Q92793 1/20 0.46
KMO O15229 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
DPP4 P27487 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA6 P23280 1/20 0.42
CA9 Q16790 1/20 0.42
SLC6A4 P31645 1/20 0.40
PLA2G2D Q9UNK4 1/20 0.40
GRIN2D O15399 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2C Q14957 1/20 0.40
HIPK2 Q9H2X6 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 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
SCHEMBL7918213 0.87 PLA2G2D (0.50) PTPN1CREBBPKMOMEN1KMT2A
SCHEMBL4649182 0.80 SLC9A1 (0.63) CYP2D6
SCHEMBL19284564 0.79 P2RY14 (0.51) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL569630 0.78 HIPK2 (0.52) PTPN1CREBBPKMODPP4GRIN2D
SCHEMBL16502635 0.78 PLA2G2D (0.45) PTPN1CREBBPKMOMEN1KMT2A
SCHEMBL3103932 0.78 PLAU (0.40) CREBBPSLC6A4
SCHEMBL10148390 0.77 RARG (0.56) CREBBPKMOCA12CA1CA2
SCHEMBL11690838 0.77 ALDH1A1 (0.51) PTPN1KMOMEN1KMT2AHIPK2
SCHEMBL30735595 0.77 IKBKB (0.46) SLC6A4P2RY14
SCHEMBL19284588 0.77 IKBKB (0.46) SLC6A4P2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 US disclosed
US-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 US disclosed
WO-2010122968-A1 DIACYLETHYLENEDIAMINE COMPOUND アステラス製薬株式会社 (JP) 2010-10-28 WO 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 (1 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-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND DGAT1, DGAT2, DIMT1 PTPN1 3792/4885CREBBP 2909/4885KMO 2307/4885

“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.