SCHEMBL4533749

SCHEMBL4533749

CCCc1cccc(-c2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGXT P21549 1/20 0.52
BCL2 P10415 1/20 0.49
CTSS P25774 1/20 0.47
CTSK P43235 1/20 0.47
GGPS1 O95749 2/20 0.46
KIF11 P52732 1/20 0.45
GPR84 Q9NQS5 1/20 0.45
HTR7 P34969 1/20 0.44
BACE1 P56817 1/20 0.44
PTGS2 P35354 1/20 0.44
AOC3 Q16853 1/20 0.44
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL10078136 0.98 AGXT (0.50) AGXTBCL2CTSSCTSKGGPS1
SCHEMBL3836772 0.96 AGXT (0.48) AGXTBCL2CTSSCTSKGGPS1
SCHEMBL24005570 0.96 CTSS (0.50) AGXTBCL2CTSSCTSKGGPS1
SCHEMBL30777855 0.93 CTSS (0.51) AGXTBCL2CTSSCTSKKIF11
SCHEMBL196298 0.93 CTSS (0.51) AGXTBCL2CTSSCTSKKIF11
SCHEMBL15238584 0.89 MCL1 (0.49) BCL2CTSSCTSKBACE1PTGS2
Formic Acid SCHEMBL27427404 0.89 GPR84 (0.49) AGXTBCL2GGPS1GPR84BACE1
SCHEMBL11515483 0.88 PSMB5 (0.49) AGXTBCL2GGPS1
SCHEMBL30500519 0.88 PSMB5 (0.49) AGXTBCL2GGPS1
SCHEMBL25380703 0.87 BCL2 (0.53) BCL2CTSSCTSKKIF11HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12441901-B2 Quantum dot ink composition, and quantum dot electroluminescent device SAMSUNG ELECTRONICS CO., LTD. (KR) 2025-10-14 US disclosed
US-20230287231-A1 QUANTUM DOT INK COMPOSITION, AND QUANTUM DOT ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-14 US disclosed
CN-116606568-A Quantum dot ink composition and quantum dot electroluminescent device 三星电子株式会社 2023-08-18 CN disclosed
US-20230257607-A1 QUANTUM DOT INK COMPOSITION, AND QUANTUM DOT ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-08-17 US disclosed
CN-115605265-A Novel compounds for the treatment and/or prevention of diseases, disorders or conditions associated with angiotensin ii 维科尔药物公司(SE) 2023-01-13 CN disclosed
US-11147796-B2 Agent for preventing or ameliorating hearing impairment TOHOKU UNIVERSITY (JP) 2021-10-19 US disclosed
US-20190224165-A1 Agent for Preventing or Ameliorating Hearing Impairment TOHOKU UNIVERSITY (JP) 2019-07-25 US disclosed
CN-109553712-A A kind of catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN disclosed
CN-109553705-A A kind of catalytic component and preparation method thereof for olefinic polymerization 中国石油化工股份有限公司 2019-04-02 CN disclosed
US-10004718-B2 Erythropoietin expression promoter TOHOKU UNIVERSITY (JP) 2018-06-26 US disclosed
US-9096565-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2015-08-04 US disclosed
CN-102245616-A Method for producing organolithium compound and method for producing substituted aromatic compound NIPPON SODA CO 2011-11-16 CN disclosed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 US disclosed
EP-0842137-A1 A PROCESS FOR THE PREPARATION OF CYCLOPROPANE CARBOXYLIC ACIDS AND INTERMEDIATES THEREFOR CHEMINOVA AGRO A/S (DK) 1998-05-20 EP disclosed
WO-1997003941-A1 A PROCESS FOR THE PREPARATION OF CYCLOPROPANE CARBOXYLIC ACIDS AND INTERMEDIATES THEREFOR CHEMINOVA AGRO A/S (DK) 1997-02-06 WO disclosed
CN-1019571-B Process for preparing biphenyl-n-propylamine derivatives and their salts CHINOIN GYOGYSZER ES VEGYESZET (HU) 1992-12-23 CN disclosed
CN-87104753-A Prepare the new diphenyl Tri N-Propyl Amine derivative and the method for salt thereof 1988-06-15 CN 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 (4 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-20090181943-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC11, HDAC3 AGXT 564/4885BCL2 2189/4885CTSS 894/4885
US-11147796-B2 Agent for preventing or ameliorating hearing impairment SLC26A4, OTC, SLC25A20 AGXT 881/4885BCL2 1418/4885CTSS 4429/4885
US-20190224165-A1 Agent for Preventing or Ameliorating Hearing Impairment SLC26A4, OTC, SLC25A20 AGXT 881/4885BCL2 1418/4885CTSS 4429/4885
US-10004718-B2 Erythropoietin expression promoter EPOR, NFE2L2, FOXO1 AGXT 617/4885BCL2 325/4885CTSS 2990/4885

“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.