SCHEMBL233251

SCHEMBL233251

CC(C)Cc1ccc2c(c1)C(=O)c1ccccc1C2=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.67
RAB9A P51151 6/20 0.67
ALDH1A1 P00352 5/20 0.67
SMN1; SMN2 Q16637 5/20 0.67
MAPK1 P28482 4/20 0.67
MAPT P10636 3/20 0.67
L3MBTL1 Q9Y468 2/20 0.67
LMNA P02545 2/20 0.67
ELANE P08246 2/20 0.52
CASP3 P42574 2/20 0.47
SENP8 Q96LD8 2/20 0.47
SENP7 Q9BQF6 2/20 0.47
SENP6 Q9GZR1 2/20 0.47
PLA2G1B P04054 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
CYP3A4 P08684 2/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL28689696 0.98 NPC1 (0.65) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL20888346 0.83 LMNA (0.46) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL3420776 0.82 NPC1 (0.59) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL9324750 0.81 NPC1 (0.62) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL36840 0.80 NPC1 (1.00) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
Anthraquinone SCHEMBL6310187 0.80 NPC1 (1.00) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL29352712 0.80 NPC1 (1.00) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL6412527 0.79 BCHE (0.42) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL183313 0.79 NPC1 (0.59) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1
SCHEMBL29530942 0.79 NPC1 (0.59) NPC1RAB9AALDH1A1SMN1; SMN2MAPK1

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113025202-B Acrylic acid modified epoxidized organic silicon photocureable coating and preparation method thereof 长沙市湘鼎涂料有限公司 2022-04-15 CN claimed
CN-113025202-A Acrylic acid modified epoxidized organic silicon photocureable coating and preparation method thereof 管善月 2021-06-25 CN claimed
EP-0158865-A2 Pregeneration of tetrahydroanthraquinone in a make-up solution to be added to a hydrogen peroxide working solution FMC Corporation (US) 1985-10-23 EP claimed
EP-0158864-A2 Process for hydrogenating an alkylated anthraquinone FMC Corporation (US) 1985-10-23 EP claimed
US-4539196-A Process for hydrogenating an alkylated anthraquinone FMC CORPORATION (US) 1985-09-03 US claimed
US-4514376-A CYCLICALLY REDUCING, OXIDIZING AND EXTRACTING A SOLUTION CONTAINING ALKYLATED ANTHROQUINONE FMC CORPORATION (US) 1985-04-30 US claimed
US-12018315-B2 Peptide nucleic acid functionalized hydrogel microneedles for sampling and detection of interstitial fluid nucleic acids MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2024-06-25 US disclosed
US-20230242969-A1 PEPTIDE NUCLEIC ACID FUNCTIONALIZED HYDROGEL MICRONEEDLES FOR SAMPLING AND DETECTION OF INTERSTITIAL FLUID NUCLEIC ACIDS HOWARD HUGHES MEDICAL INSTITUTE 2023-08-03 US disclosed
CN-113025202-B Acrylic acid modified epoxidized organic silicon photocureable coating and preparation method thereof 长沙市湘鼎涂料有限公司 2022-04-15 CN disclosed
CN-113025202-A Acrylic acid modified epoxidized organic silicon photocureable coating and preparation method thereof 管善月 2021-06-25 CN disclosed
US-20210032222-A1 FIVE-MEMBERED RING-SUBSTITUTED PYRIDAZINOL COMPOUNDS AND DERIVATIVES, PREPARATION METHODS, HERBICIDAL COMPOSITIONS AND APPLICATIONS THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2021-02-04 US disclosed
US-20210032229-A1 PYRIDINE RING-SUBSTITUTED PYRIDAZINOL COMPOUNDS AND DERIVATIVES, PREPARATION METHODS, HERBICIDAL COMPOSITIONS AND APPLICATIONS THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2021-02-04 US disclosed
US-20200377929-A1 PEPTIDE NUCLEIC ACID FUNCTIONALIZED HYDROGEL MICRONEEDLES FOR SAMPLING AND DETECTION OF INTERSTITIAL FLUID NUCLEIC ACIDS MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2020-12-03 US disclosed
EP-1245534-A2 Hydrogenation of a working solution in a hydrogen peroxide production process KEMIRA CHEMICALS OY (FI) 2002-10-02 EP disclosed
WO-2001066461-A1 REGENERATION OF A WORKING SOLUTION IN A HYDROGEN PEROXIDE PRODUCTION PROCESS KEMIRA CHEMICALS OY (FI) 2001-09-13 WO disclosed
EP-0025620-B1 PROCESS FOR THE PREPARATION OF SUBSTITUTED ANTHRAQUINONES INTEROX Société Anonyme (BE) 1983-06-22 EP disclosed
US-4355012-A Mixed anthraquinonedisulfonic acids AMERICAN COLOR & CHEMICAL CORPORATION (US) 1982-10-19 US disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 US disclosed
US-4312811-A DEHYDROCHLORINATION OF ORTHO-BENZOYLBENZOIC ACID CHLORIDE INTEROX (SOCIETE ANONYME) (BE) 1982-01-26 US disclosed
EP-0025620-A1 Process for the preparation of substituted anthraquinones INTEROX Société Anonyme (BE) 1981-03-25 EP 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-20210032229-A1 PYRIDINE RING-SUBSTITUTED PYRIDAZINOL COMPOUNDS AND DERIVATIVES, PREPARATION METHODS, HERBICIDAL COMPOSITIONS AND APPLICATIONS THEREOF CBR3, CBR1, H1-0 NPC1 4527/4885RAB9A 3172/4885ALDH1A1 1438/4885
US-20210032222-A1 FIVE-MEMBERED RING-SUBSTITUTED PYRIDAZINOL COMPOUNDS AND DERIVATIVES, PREPARATION METHODS, HERBICIDAL COMPOSITIONS AND APPLICATIONS THEREOF CBR3, CBR1, CYP8B1 NPC1 4435/4885RAB9A 1211/4885ALDH1A1 983/4885

“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.