SCHEMBL178777

SCHEMBL178777

O=C(NC(C(=O)O)C1CCCC1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 3/20 0.49
MDM4 O15151 3/20 0.49
TP53 P04637 3/20 0.49
KMT2A Q03164 2/20 0.49
EPHX2 P34913 1/20 0.46
TLR2 O60603 1/20 0.43
MDM2 Q00987 1/20 0.43
FABP7 O15540 1/20 0.43
FABP5 Q01469 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
SCHEMBL30291644 1.00 CASP3 (0.49) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL30291765 1.00 CASP3 (0.49) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL29855153 1.00 CASP3 (0.49) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL17256393 1.00 CASP3 (0.49) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL29400169 1.00 CASP3 (0.49) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL13697519 0.99 MDM4 (0.48) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL178788 0.99 MDM4 (0.48) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL10231780 0.99 MDM4 (0.48) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL20825662 0.99 MDM4 (0.48) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL1405653 0.99 MDM4 (0.48) CASP3MDM4TP53KMT2AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4512818-A1 CYCLIC COMPOUND HAVING SELECTIVE KRAS INHIBITORY EFFECT ON HRAS AND NRAS Chugai Seiyaku Kabushiki Kaisha (JP) 2025-02-26 EP disclosed
US-20240158446-A1 CYCLIC COMPOUND HAVING SELECTIVE INHIBITORY ACTION ON KRAS OVER HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-16 US disclosed
US-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-09 US disclosed
EP-4316503-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-02-07 EP disclosed
EP-4309741-A1 CYCLIC COMPOUND HAVING INHIBITORY EFFECT SELECTIVE FOR KRAS BUT NOT FOR HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-01-24 EP disclosed
CN-117279928-A Process for the preparation of cyclic compounds comprising N-substituted amino acid residues 中外制药株式会社 2023-12-22 CN disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 US disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 US disclosed
US-10851367-B2 Tissue-specific genome engineering using CRISPR-Cas9 PFIZER INC. (US) 2020-12-01 US disclosed
US-10813942-B2 Substituted-6,8-dioxabicyclo[3.2.1]octane-2,3-diol compounds as targeting agents of ASGPR PFIZER INC. (US) 2020-10-27 US disclosed
US-20190321382-A1 SUBSTITUTED-6,8-DIOXABICYCLO[3.2.1]OCTANE-2,3-DIOL COMPOUNDS AS TARGETING AGENTS OF ASGPR PFIZER INC. (US) 2019-10-24 US disclosed
US-10376531-B2 Substituted-6,8-dioxabicyclo[3.2.1]octane-2,3-diol compounds as targeting agents of ASGPR PFIZER INC. (US) 2019-08-13 US disclosed
US-10039778-B2 Substituted-6,8-dioxabicyclo[3.2.1]octane-2,3-diol compounds as targeting agents of ASGPR PFIZER INC. (US) 2018-08-07 US disclosed
WO-2017083368-A9 TISSUE-SPECIFIC GENOME ENGINEERING USING CRISPR-CAS9 PFIZER INC. (US) 2018-04-12 WO disclosed
US-20170165284-A1 SUBSTITUTED-6,8-DIOXABICYCLO[3.2.1]OCTANE-2,3-DIOL COMPOUNDS AS TARGETING AGENTS OF ASGPR PFIZER INC. (US) 2017-06-15 US disclosed
US-20170137801-A1 TISSUE-SPECIFIC GENOME ENGINEERING USING CRISPR-CAS9 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-05-18 US disclosed
WO-2017083368-A1 TISSUE-SPECIFIC GENOME ENGINEERING USING CRISPR-CAS9 PFIZER INC. (US) 2017-05-18 WO disclosed
US-9617293-B2 Substituted-6,8-dioxabicyclo[3.2.1]octane-2,3-diol compounds as targeting agents of ASGPR PFIZER INC. (US) 2017-04-11 US disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 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 (9 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-20170165284-A1 SUBSTITUTED-6,8-DIOXABICYCLO[3.2.1]OCTANE-2,3-DIOL COMPOUNDS AS TARGETING AGENTS OF ASGPR ASGR1, MRGPRX2, LDLR CASP3 2826/4885MDM4 4883/4885TP53 3852/4885
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS CASP3 3906/4885MDM4 441/4885TP53 34/4885
US-20240158446-A1 CYCLIC COMPOUND HAVING SELECTIVE INHIBITORY ACTION ON KRAS OVER HRAS AND NRAS KRAS, HRAS, NRAS CASP3 3300/4885MDM4 476/4885TP53 10/4885
US-10813942-B2 Substituted-6,8-dioxabicyclo[3.2.1]octane-2,3-diol compounds as targeting agents of ASGPR ASGR1, MRGPRX2, LDLR CASP3 2826/4885MDM4 4883/4885TP53 3852/4885
US-10851367-B2 Tissue-specific genome engineering using CRISPR-Cas9 ASGR1, LDLR, HAVCR2 CASP3 3410/4885MDM4 4762/4885TP53 781/4885
US-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND VIP, IAPP, KRAS CASP3 3268/4885MDM4 1294/4885TP53 178/4885
US-20190321382-A1 SUBSTITUTED-6,8-DIOXABICYCLO[3.2.1]OCTANE-2,3-DIOL COMPOUNDS AS TARGETING AGENTS OF ASGPR ASGR1, MRGPRX2, LDLR CASP3 2826/4885MDM4 4883/4885TP53 3852/4885
US-10039778-B2 Substituted-6,8-dioxabicyclo[3.2.1]octane-2,3-diol compounds as targeting agents of ASGPR ASGR1, MRGPRX2, LDLR CASP3 2826/4885MDM4 4883/4885TP53 3852/4885
US-10376531-B2 Substituted-6,8-dioxabicyclo[3.2.1]octane-2,3-diol compounds as targeting agents of ASGPR ASGR1, MRGPRX2, LDLR CASP3 2826/4885MDM4 4883/4885TP53 3852/4885

“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.