SCHEMBL6037020

SCHEMBL6037020

O=C(S)CN1C(=O)CCC1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 7/20 0.42
ALOX12 P18054 1/20 0.42
TSHR P16473 3/20 0.41
LMNA P02545 2/20 0.40
HPGD P15428 2/20 0.38
GAA P10253 3/20 0.36
KDM4E B2RXH2 3/20 0.36
GFER P55789 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
CDK5 Q00535 1/20 0.34
CDK5R1 Q15078 1/20 0.34
HTT P42858 1/20 0.34
POLB P06746 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33

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
SCHEMBL871728 0.87 ALDH1A1 (0.41) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL10015377 0.81 SMN1; SMN2 (0.41) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL236431 0.77 TSHR (0.56) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL16841649 0.76 TSHR (0.42) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL13907969 0.76 ALDH1A1 (0.43) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL5091798 0.75 TSHR (0.44) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL14769217 0.75 TSHR (0.52) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL7773775 0.75 SMN1; SMN2 (0.43) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL2719070 0.75 ALDH1A1 (0.43) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR
SCHEMBL8577573 0.75 ALDH1A1 (0.46) SMN1; SMN2RAB9AALDH1A1ALOX12TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024133763-A2 ALPP-SPECIFIC VARIANT ANTIGEN BINDING MOLECULES ALMAC DISCOVERY LIMITED (GB) 2024-06-27 WO disclosed
WO-2023247729-A1 ROR1/EGFR BI-SPECIFIC ANTIGEN BINDING MOLECULES ALMAC DISCOVERY LIMITED (GB) 2023-12-28 WO disclosed
WO-2023247731-A1 ROR1/PTK7 BI-SPECIFIC ANTIGEN BINDING MOLECULES ALMAC DISCOVERY LIMITED (GB) 2023-12-28 WO disclosed
EP-4262987-A1 ROR1-SPECIFIC VARIANT ANTIGEN BINDING MOLECULES Almac Discovery Limited (GB) 2023-10-25 EP disclosed
US-20230241072-A1 ANTHRACYCLINE DERIVATIVES ALMAC DISCOVERY LIMITED (GB) 2023-08-03 US disclosed
WO-2022129622-A1 ROR1-SPECIFIC VARIANT ANTIGEN BINDING MOLECULES ALMAC DISCOVERY LIMITED (GB) 2022-06-23 WO disclosed
EP-3986473-A1 ANTHRACYCLINE DERIVATIVES Almac Discovery Limited (GB) 2022-04-27 EP disclosed
WO-2020254640-A1 ANTHRACYCLINE DERIVATIVES ALMAC DISCOVERY LIMITED (GB) 2020-12-24 WO disclosed
CN-106163559-A anti-HER 3 antibody-drug conjugates 第三共株式会社 2016-11-23 CN disclosed
CN-104583775-B Assay tag 维瓦克塔有限公司 2016-08-24 CN disclosed
CN-102046203-A Conjugated molecules comprising a peptide derived from the CD4 receptor coupled to a polyanion for the treatment of aids PASTEUR INSTITUT 2011-05-04 CN disclosed
CN-101072581-A Therapeutic agents with reduced toxicity GENENTECH INC (US) 2007-11-14 CN disclosed
CN-1309416-C Novel pharmaceutical composition HOFFMANN LA ROCHE (CH) 2007-04-11 CN disclosed
CN-1901934-A Use of erythropoietin in the treatment of disturbances of iron distribution in chronic inflammatory bowel disease HOFFMANN LA ROCHE (CH) 2007-01-24 CN disclosed
US-7152462-B2 Topography and recognition imaging atomic force microscope and method of operation AGILENT TECHNOLOGIES, INC (US) 2006-12-26 US disclosed
US-20060016251-A1 Topography and recognition imaging atomic force microscope and method of operation KEYSIGHT TECHNOLOGIES, INC. 2006-01-26 US disclosed
US-6952952-B2 Topography and recognition imaging atomic force microscope and method of operation MOLECULAR IMAGING CORPORATION (US) 2005-10-11 US disclosed
US-20040129064-A1 For detecting interactions between a probe and a sensed agent on a scanned surface KEYSIGHT TECHNOLOGIES, INC. 2004-07-08 US disclosed
WO-2004042741-A2 TOPOGRAPHY AND RECOGNITION IMAGING ATOMIC FORCE MICROSCOPE AND METHOD OF OPERATION MOLECULAR IMAGING CORPORATION (US) 2004-05-21 WO disclosed
CN-1429116-A Novel pharmaceutical composition HOFFMANN LA ROCHE (CH) 2003-07-09 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 (1 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-20230241072-A1 ANTHRACYCLINE DERIVATIVES TOP2A, TOP2B, BCL6 SMN1; SMN2 4427/4885RAB9A 1006/4885ALDH1A1 1813/4885

“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.