SCHEMBL7018296

SCHEMBL7018296

CCOC(=O)Cc1nc2ccccc2n1C

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.58
NPC1 O15118 4/20 0.58
HDAC6 Q9UBN7 1/20 0.56
KDM4E B2RXH2 3/20 0.53
HSD17B10 Q99714 3/20 0.53
ALDH1A1 P00352 2/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
RXFP1 Q9HBX9 1/20 0.52
PDE10A Q9Y233 1/20 0.52
MAPT P10636 1/20 0.51
GAA P10253 2/20 0.51
TSHR P16473 1/20 0.51
PSMD14 O00487 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL6000128 0.83 NPC1 (0.61) RAB9ANPC1HDAC6KDM4EHSD17B10
SCHEMBL11431402 0.82 POLB (0.52) KDM4EHSD17B10ALDH1A1HPGDHTT
SCHEMBL9262855 0.82 SMN1; SMN2 (0.65) RAB9ANPC1HDAC6KDM4EALDH1A1
Hydrochloric Acid SCHEMBL6000120 0.82 NPC1 (0.60) RAB9ANPC1HDAC6KDM4EHSD17B10
SCHEMBL17933571 0.80 HDAC6 (0.72) RAB9ANPC1HDAC6KDM4EALDH1A1
SCHEMBL7069710 0.80 HPGD (0.48) RAB9ANPC1HDAC6KDM4EHSD17B10
SCHEMBL17380973 0.80 POLB (0.58) RAB9AKDM4EHSD17B10ALDH1A1HTT
SCHEMBL7978871 0.80 AKT1 (0.42) RAB9ANPC1KDM4EHSD17B10ALDH1A1
SCHEMBL13649430 0.79 HDAC6 (0.61) RAB9ANPC1HDAC6KDM4EALDH1A1
SCHEMBL9675374 0.79 AKR1B1 (0.76) KDM4EALDH1A1MEN1KMT2ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114573604-B Quinolone-based compound, preparation method thereof, pharmaceutical composition containing quinolone-based compound and application of quinolone-based compound 中国科学院上海药物研究所 2024-06-18 CN disclosed
CN-113597547-B Fluorescent imaging agent for lipid droplets in cells and tissues 国立大学法人群马大学 2024-04-30 CN disclosed
CN-113597547-A Fluorescent imaging agent for lipid droplets in cells and tissues 国立大学法人群马大学 2021-11-02 CN disclosed
US-10590134-B2 Compositions, uses and methods for making them Pimera, Inc. (US) 2020-03-17 US disclosed
US-20180079750-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM UNITED STATES GOVERNMENT 2018-03-22 US disclosed
EP-0972769-B1 NOVEL AMIDE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF YAMANOUCHI PHARMA CO LTD (JP) 2003-04-16 EP disclosed
US-6177454-B1 ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2001-01-23 US disclosed
US-6048884-A ANTIDIABETIC AGENTS; HYPOGLYCEMIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2000-04-11 US disclosed
EP-0972769-A1 NOVEL AMIDE DERIVATIVES AND MEDICINAL COMPOSITIONS THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2000-01-19 EP disclosed
US-4003750-A METHINE DYES EASTMAN KODAK COMPANY (US) 1977-01-18 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-10590134-B2 Compositions, uses and methods for making them BAX, CASP3, BCL2 RAB9A 3371/4885NPC1 1273/4885HDAC6 457/4885
US-20180079750-A1 NOVEL COMPOSITIONS, USES AND METHODS FOR MAKING THEM BAX, CASP3, BCL2 RAB9A 3102/4885NPC1 1234/4885HDAC6 349/4885

“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.