SCHEMBL4391794

SCHEMBL4391794

O=C(O)C1c2ccccc2C(=O)N(Cc2ccc(Cl)cc2)C1c1ccc(Cl)s1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 5/20 0.72
MAPT P10636 2/20 0.54
TP53 P04637 2/20 0.52
FFAR1 O14842 9/20 0.48
HTT P42858 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL29921559 1.00 MDM2 (0.72) MDM2MAPTTP53FFAR1HTT
SCHEMBL29921540 0.84 MDM2 (1.00) MDM2MAPTTP53FFAR1HTT
SCHEMBL2054557 0.84 MDM2 (1.00) MDM2MAPTTP53FFAR1HTT
SCHEMBL2098298 0.84 MDM2 (1.00) MDM2MAPTTP53FFAR1HTT
SCHEMBL2054561 0.84 MDM2 (1.00) MDM2MAPTTP53FFAR1HTT
SCHEMBL2054558 0.84 MDM2 (1.00) MDM2MAPTTP53FFAR1HTT
SCHEMBL2054556 0.84 MDM2 (1.00) MDM2MAPTTP53FFAR1HTT
SCHEMBL2335618 0.83 MDM2 (0.60) MDM2MAPTTP53HTTALDH1A1
SCHEMBL29921785 0.83 MDM2 (0.79) MDM2MAPTTP53HTTALDH1A1
Formic Acid SCHEMBL4391431 0.80 MDM2 (0.57) MDM2MAPTTP53HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367699-B2 Tetrahydro-isoquinolines NEXUSPHARMA, INC. (US) 2013-02-05 US claimed
US-20090306130-A1 NOVEL TETRAHYDRO-ISOQUINOLINES NEXUSPHARMA, INC. 2009-12-10 US claimed
EP-4548977-A2 NOVEL ISOQUINOLINES AS PROTEIN DEGRADERS, E7 DEGRADERS, ANTIVIRALS, TUMOR THERAPEUTICS AND IMMUNE SUPPRESSIVES RDP Pharma AG (CH) 2025-05-07 EP disclosed
US-20240208925-A1 ISOQUINOLINE DERIVATIVES FOR USE AS ANTIVIRAL AND ANTITUMOUR AGENTS PAGS CO., LTD. (KR) 2024-06-27 US disclosed
CN-117377474-A Isoquinoline derivatives as antiviral and antitumor agents RDP制药股份公司 2024-01-09 CN disclosed
EP-4074314-A1 ISOQUINOLINE DERIVATIVES FOR USE AS ANTIVIRAL AND ANTITUMOUR AGENTS Valdospan GmbH (AT) 2022-10-19 EP disclosed
US-8367699-B2 Tetrahydro-isoquinolines NEXUSPHARMA, INC. (US) 2013-02-05 US disclosed
US-20090306130-A1 NOVEL TETRAHYDRO-ISOQUINOLINES NEXUSPHARMA, INC. 2009-12-10 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-20090306130-A1 NOVEL TETRAHYDRO-ISOQUINOLINES ING2, NOTCH2, HMGB2 MDM2 22/4885MAPT 877/4885TP53 72/4885
US-20240208925-A1 ISOQUINOLINE DERIVATIVES FOR USE AS ANTIVIRAL AND ANTITUMOUR AGENTS TP53, EIF2AK2, VHL MDM2 18/4885MAPT 3304/4885TP53 1/4885

“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.