SCHEMBL1654271

SCHEMBL1654271

COCCOCCOCCOCCOCCOCC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA2 P00918 1/20 0.36
TSHR P16473 2/20 0.36
CTH P32929 1/20 0.36
CBS P35520 1/20 0.36
THPO P40225 1/20 0.36
THRB P10828 1/20 0.35
EPHX2 P34913 1/20 0.34
PTGS1 P23219 1/20 0.33
CYP2C19 P33261 1/20 0.33
NAMPT P43490 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 1/20 0.32
F2 P00734 1/20 0.32
ELANE P08246 1/20 0.32
ABCB11 O95342 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL3545628 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL3547165 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL10019282 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL18244613 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL3542040 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL3541625 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL102373 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL21877046 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL21876707 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2
SCHEMBL31074305 1.00 ALDH1A1 (0.43) ALDH1A1BLMPMP22HSD17B10CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1854792-B1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2012-12-26 EP claimed
WO-2024172341-A1 QUANTUM DOT, METHOD FOR PREPARING QUANTUM DOT, QUANTUM DOT COMPOSITION, AND ELECTRONIC DEVICE 덕산네오룩스 주식회사 2024-08-22 WO disclosed
US-20240279710-A1 FLUORESCENT PROBES TOHOKU TECHNO ARCH CO., LTD. (JP) 2024-08-22 US disclosed
EP-4361166-A1 FLUORESCENT PROBES Tohoku Techno Arch Co., Ltd. (JP) 2024-05-01 EP disclosed
CN-117480175-A Fluorescent probe 东北泰克诺亚奇股份有限公司 2024-01-30 CN disclosed
US-20230158141-A1 Conjugates of Biomolecule and Use Thereof YAFEI SHANGHAI BIOLOG MEDICINE SCIENCE & TECHNOLOG (CN) 2023-05-25 US disclosed
EP-3294714-B1 MORPHINAN DERIVATIVES FOR THE TREATMENT OF NEUROPATHIC PAIN NEKTAR THERAPEUTICS (US) 2023-03-15 EP disclosed
US-11111214-B2 Kappa opioid agonists and uses thereof NEKTAR THERAPEUTICS (US) 2021-09-07 US disclosed
US-10766864-B2 Morphinan derivatives for the treatment of neuropathic pain NEKTAR THERAPEUTICS (US) 2020-09-08 US disclosed
US-10682371-B2 Small molecule conjugates specifically activated in tumor microenvironment for targeting and use thereof YAFEI SHANGHAI BIOLOG MEDICINE SCIENCE & TECHNOLOGY CO. LTD. (CN) 2020-06-16 US disclosed
US-7820693-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-10-26 US disclosed
US-20090030195-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-01-29 US disclosed
EP-1904462-A2 COMPLEXES CONTAINING PERFLUOROALKYL, METHOD FOR THE PRODUCTION AND USE THEREOF Bayer Schering Pharma Aktiengesellschaft (DE) 2008-04-02 EP disclosed
EP-1854792-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-11-14 EP disclosed
WO-2007009637-A2 COMPLEXES CONTAINING PERFLUOROALKYL, THEIR USE AS CONTRAST MEDIA FOR NMR, X-RAY AND RADIO DIAGNOSIS AND RADIOTHERAPY BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-25 WO disclosed
US-20070020183-A1 Perfluoroalkyl-containing complexes, process for their production as well as their use BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-25 US disclosed
US-6080771-A LEINAMYCIN DERIVATIVES ARE USED AS BACTERICIDE AND ANTITUMOR AGENTS KYOWA HAKKO KOGYO CO., LTD. (JP) 2000-06-27 US disclosed
US-5981558-A ANTIMICROBIAL ACTIVITY AND ANTITUMOR ACTIVITY KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-11-09 US disclosed
EP-0918058-A1 DC 107 DERIVATIVES (1) KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-05-26 EP disclosed
EP-0887351-A1 DC 107 DERIVATIVES (2) KYOWA HAKKO KOGYO CO., LTD. (JP) 1998-12-30 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 (7 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-20070020183-A1 Perfluoroalkyl-containing complexes, process for their production as well as their use AFF1, FRG1, AFF2 ALDH1A1 2789/4885BLM 2263/4885PMP22 218/4885
US-20240279710-A1 FLUORESCENT PROBES CAPN1, CAPN2, CAPNS1 ALDH1A1 2622/4885BLM 4881/4885PMP22 3228/4885
US-20230158141-A1 Conjugates of Biomolecule and Use Thereof CD47, FCGR2A, CD40 ALDH1A1 2422/4885BLM 1823/4885PMP22 1594/4885
US-10682371-B2 Small molecule conjugates specifically activated in tumor microenvironment for targeting and use thereof MET, ARG1, CD4 ALDH1A1 3371/4885BLM 3197/4885PMP22 4877/4885
US-10766864-B2 Morphinan derivatives for the treatment of neuropathic pain OPRM1, OPRL1, OPRK1 ALDH1A1 898/4885BLM 4232/4885PMP22 393/4885
US-20090030195-A1 1-(2H)-ISOQUINOLONE DERIVATIVE NQO1, NR5A1, SRD5A1 ALDH1A1 371/4885BLM 924/4885PMP22 4743/4885
US-11111214-B2 Kappa opioid agonists and uses thereof OPRK1, OPRD1, OPRM1 ALDH1A1 782/4885BLM 4855/4885PMP22 2784/4885

“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.