SCHEMBL1076339

SCHEMBL1076339

C=C[C](N)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 1/20 0.52
▸ TSHR P16473 3/20 0.46
▸ BLM P54132 2/20 0.46
▸ RECQL P46063 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ F2 P00734 1/20 0.46
▸ F10 P00742 1/20 0.46
▸ F12 P00748 1/20 0.46
▸ F7 P08709 1/20 0.46
▸ F3 P13726 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ PARP1 P09874 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ KMT2A Q03164 2/20 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
SCHEMBL2185852 0.75 AKT1 (0.59) AKT1TSHRBLMRECQLTDP1
SCHEMBL18189195 0.74 AKT1 (0.52) AKT1TSHRBLMRECQLTDP1
SCHEMBL1403013 0.74 TDP1 (0.54) AKT1TSHRBLMRECQLTDP1
Benzamide SCHEMBL8991968 0.73 PARP1 (0.73) AKT1TSHRBLMRECQLTDP1
Benzoic Acid SCHEMBL3718190 0.73 TSHR (0.64) AKT1TSHRBLMRECQLTDP1
Benzophenone SCHEMBL1884581 0.73 ALDH1A1 (0.64) AKT1TSHRBLMRECQLTDP1
Benzoic Acid SCHEMBL26696911 0.73 TSHR (0.64) AKT1TSHRBLMRECQLTDP1
Acrylamide SCHEMBL28673779 0.73 AKT1 (0.58) AKT1TSHRBLMRECQLTDP1
SCHEMBL23328518 0.72 AKT1 (0.56) AKT1TSHRBLMRECQLTDP1
SCHEMBL630088 0.72 AKT1 (0.56) AKT1TSHRBLMRECQLTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103755743-B Method for producing a ruthenium complex 高砂香料工业株式会社 2017-05-10 — — CN claimed
CN-101676294-B Method for producing ruthenium complex TAKASAGO PERFUMERY CO LTD 2014-06-18 — — CN claimed
CN-103755743-A Method for producing a ruthenium complex TAKASAGO PERFUMERY CO LTD 2014-04-30 — — CN claimed
EP-2166014-B1 Method for producing a ruthenium complex TAKASAGO PERFUMERY CO LTD (JP) 2012-11-14 — — EP claimed
US-7964744-B2 Method for producing a ruthenium complex TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-06-21 — — US claimed
EP-2275429-A2 Method for producing a ruthenium complex Takasago International Corporation (JP) 2011-01-19 — — EP claimed
US-20100076210-A1 METHOD FOR PRODUCING A RUTHENIUM COMPLEX TAKASAGO INTERNATIONAL CORPORATION (JP) 2010-03-25 — — US claimed
EP-2166014-A2 Method for producing a ruthenium complex Takasago International Corporation (JP) 2010-03-24 — — EP claimed
CN-101676294-A Method for producing ruthenium complex TAKASAGO PERFUMERY CO LTD 2010-03-24 — — CN claimed
US-20050239808-A1 Active substances for the treatment, diagnosis and prophylaxis of diseases in which abnormal protein structures occur TRANSMIT GESELLSCHAFT FUR TECHNOLOGIETRANSFER MBH (DE) 2005-10-27 — — US claimed
EP-1503990-A1 ACTIVE SUBSTANCES FOR THE TREATMENT, DIAGNOSIS AND PROPHYLAXIS OF DISEASES IN WHICH ABNORMAL PROTEIN STRUCTURES OCCUR Transmit Gesellschaft für Technologietransfer mbH (DE) 2005-02-09 — — EP claimed
WO-2003095429-A1 ACTIVE SUBSTANCES FOR THE TREATMENT, DIAGNOSIS AND PROPHYLAXIS OF DISEASES IN WHICH ABNORMAL PROTEIN STRUCTURES OCCUR TransMIT Gesellschaft für Technologietransfer mbH (DE) 2003-11-20 — — WO claimed
US-4962230-A RUTHENIUM-OPTICALLY ACTIVE PHOSPHINE COMPLEX HYDROGENATION CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 1990-10-09 — — US claimed
US-20230348398-A1 Benzimidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2023-11-02 — — US disclosed
CN-103755743-B Method for producing a ruthenium complex 高砂香料工业株式会社 2017-05-10 — — CN disclosed
CN-103755743-B Method for producing a ruthenium complex 高砂香料工业株式会社 2017-05-10 — — CN disclosed
EP-0196174-B1 MEANS FOR SEQUENTIAL SOLID PHASE ORGANIC SYNTHESIS AND METHODS USING THE SAME SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1990-01-17 — — EP disclosed
EP-0257486-A1 Modified polyphenylene ether resins having improved processability and oxidative stability GENERAL ELECTRIC COMPANY (US) 1988-03-02 — — EP disclosed
US-4631211-A REACTIVE PARTICLES ENCLOSED IN WATER AND SOLVENT-INSOLUBLE MESH CONTAINER; PEPTIDE SYNTHESIS SCRIPPS CLINIC & RESEARCH FOUNDATION (US) 1986-12-23 — — US disclosed
EP-0196174-A2 Means for sequential solid phase organic synthesis and methods using the same SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1986-10-01 — — 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 (3 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-20230348398-A1 Benzimidazole derivatives HRH4, H1-4, CYP3A4 AKT1 4161/4885TSHR 388/4885BLM 1614/4885
US-20100076210-A1 METHOD FOR PRODUCING A RUTHENIUM COMPLEX OGFRL1, OPRM1, OLA1 AKT1 2761/4885TSHR 1364/4885BLM 4284/4885
US-20050239808-A1 Active substances for the treatment, diagnosis and prophylaxis of diseases in which abnormal protein structures occur PRNP, APP, MAPT AKT1 3368/4885TSHR 4200/4885BLM 2782/4885

“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.

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