SCHEMBL3437036

SCHEMBL3437036

CN1CC(N2CCCCC2)C1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.35
ALDH1A1 P00352 1/20 0.34
L3MBTL3 Q96JM7 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
HTR6 P50406 1/20 0.33
HRH3 Q9Y5N1 3/20 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
SCHEMBL13791869 1.00 FYN (0.35) FYNALDH1A1L3MBTL3L3MBTL1HTR6
SCHEMBL12038515 0.97 ALDH1A1 (0.35) FYNALDH1A1L3MBTL3L3MBTL1HTR6
SCHEMBL18136222 0.92
SCHEMBL18035317 0.91 FYN (0.31) FYNALDH1A1L3MBTL3L3MBTL1
SCHEMBL24185469 0.85 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8272492 0.82 ALDH1A1 (0.43) ALDH1A1L3MBTL3L3MBTL1HRH3
SCHEMBL8438291 0.82 ALDH1A1 (0.43) ALDH1A1L3MBTL3L3MBTL1HRH3
SCHEMBL8374383 0.82 ALDH1A1 (0.43) ALDH1A1L3MBTL3L3MBTL1HRH3
SCHEMBL8272489 0.82 ALDH1A1 (0.43) ALDH1A1L3MBTL3L3MBTL1HRH3
SCHEMBL8439289 0.82 ALDH1A1 (0.43) ALDH1A1L3MBTL3L3MBTL1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11730720-B2 ALK5 inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-08-22 US disclosed
US-11730720-B2 ALK5 inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-08-22 US disclosed
WO-2022253250-A1 BRUTON'S TYROSINE KINASE DEGRADER CONTAINING FUSED-RING OR SPIRO-RING 正大天晴药业集团股份有限公司 2022-12-08 WO disclosed
WO-2021180235-A1 INHIBITOR OF ENHANCER OF ZESTE HOMOLOGUE 2, AND USE THEREOF 四川海思科制药有限公司 2021-09-16 WO disclosed
WO-2021129820-A1 SPIRO RING-CONTAINING QUINAZOLINE COMPOUND 微境生物医药科技(上海)有限公司 2021-07-01 WO disclosed
US-20210154178-A1 ALK5 INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-05-27 US disclosed
WO-2021077010-A1 BIFUNCTIONAL MOLECULES CONTAINING AN E3 UBIQUITINE LIGASE BINDING MOIETY LINKED TO A BCL6 TARGETING MOIETY ARVINAS OPERATIONS, INC. (US) 2021-04-22 WO disclosed
US-10952996-B2 ALK5 inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-03-23 US disclosed
EP-3680237-A1 PROCESS FOR PREPARING SUBSTITUTED 2,3-DIHYDRO-1H-INDEN-1-ONE RETINOIC ACID-RELATED ORPHAN NUCLEAR RECEPTOR ANTAGONISTS FOR TREATING MULTIPLE SCLEROSIS Arrien Pharmaceuticals LLC (US) 2020-07-15 EP disclosed
WO-2020123453-A2 ALK5 INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-06-18 WO disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 US disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 US disclosed
US-7547692-B2 Rifamycin analogs and uses thereof ACTIVBIOTICS PHARMA, LLC (US) 2009-06-16 US disclosed
EP-2009005-A1 AZOLECARBOXAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2008-12-31 EP disclosed
US-20080227785-A1 2,4,6-TRIAMINO-1,3,5-TRIAZINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2008-09-18 US disclosed
US-20080227785-A1 2,4,6-TRIAMINO-1,3,5-TRIAZINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2008-09-18 US disclosed
US-7375222-B2 2,4,6-Triamino-1,3,5-triazine derivative ASTELLAS PHARMA INC. (JP) 2008-05-20 US disclosed
US-7375222-B2 2,4,6-Triamino-1,3,5-triazine derivative ASTELLAS PHARMA INC. (JP) 2008-05-20 US disclosed
US-20070155715-A1 Rifamycin analogs and uses thereof ACTIVBIOTICS, INC. (US) 2007-07-05 US disclosed
US-20070142392-A1 Uses of rifamycins ACTIVBIOTICS, INC. (US) 2007-06-21 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 (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-10952996-B2 ALK5 inhibitors ALK, ACVR1, ACVRL1 FYN 1350/4885ALDH1A1 3284/4885L3MBTL3 1287/4885
US-20070142392-A1 Uses of rifamycins TNF, TLR6, IL6 FYN 2461/4885ALDH1A1 1604/4885L3MBTL3 3521/4885
US-20210154178-A1 ALK5 INHIBITORS ALK, ACVR1, ACVRL1 FYN 1350/4885ALDH1A1 3284/4885L3MBTL3 1287/4885
US-11730720-B2 ALK5 inhibitors ALK, ACVR1, ACVRL1 FYN 1350/4885ALDH1A1 3284/4885L3MBTL3 1287/4885
US-20080227785-A1 2,4,6-TRIAMINO-1,3,5-TRIAZINE DERIVATIVE KCNT1, KCNMA1, KCNJ2 FYN 2105/4885ALDH1A1 2383/4885L3MBTL3 1992/4885
US-20070155715-A1 Rifamycin analogs and uses thereof RIF1, FNTB, MRPL21 FYN 4403/4885ALDH1A1 2111/4885L3MBTL3 1403/4885
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 FYN 147/4885ALDH1A1 975/4885L3MBTL3 3188/4885

“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.