SCHEMBL717587

SCHEMBL717587

CN1C(=O)CCC(Cc2ccccc2)C1=O

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.50
CRBN Q96SW2 1/20 0.50
HSD11B1 P28845 2/20 0.49
KMT2A Q03164 4/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
TSHR P16473 2/20 0.44
MEN1 O00255 2/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
MAPK1 P28482 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
SCHEMBL5088875 0.77 HSD11B1 (0.59) DDB1CRBNHSD11B1KMT2ANPC1
SCHEMBL6734403 0.74 HSD11B1 (0.56) DDB1CRBNHSD11B1KMT2ANPC1
SCHEMBL11684304 0.74 KMT2A (0.48) HSD11B1KMT2ANPC1ALDH1A1RAB9A
SCHEMBL6879875 0.73 SRD5A1 (0.42) DDB1CRBN
SCHEMBL29016897 0.73 DDB1 (0.61) DDB1CRBNHSD11B1KMT2A
SCHEMBL28995160 0.72 DRD2 (0.46) KMT2ANPC1ALDH1A1RAB9ATSHR
SCHEMBL30489343 0.72 DRD2 (0.46) KMT2ANPC1ALDH1A1RAB9ATSHR
SCHEMBL9800237 0.71 KMT2A (0.69) DDB1CRBNKMT2ATSHRMEN1
SCHEMBL28942364 0.70 HSD11B1 (0.59) DDB1CRBNHSD11B1KMT2ANPC1
SCHEMBL5106732 0.70 HSD11B1 (0.59) DDB1CRBNHSD11B1KMT2ANPC1

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-20230293702-A1 QUINAZOLINES, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS BIOTHERYX, INC. 2023-09-21 US disclosed
US-9150414-B2 Nanocomposite and dispersion comprising the same KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2015-10-06 US disclosed
US-20120053288-A1 NANOCOMPOSITE AND DISPERSION COMPRISING THE SAME KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2012-03-01 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 (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-20230293702-A1 QUINAZOLINES, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS RAB1A, SOS1, IQGAP1 DDB1 2095/4885CRBN 3656/4885HSD11B1 629/4885

“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.