SCHEMBL29416448

SCHEMBL29416448

c1cnc2c(c1)CCCN2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 1/20 0.44
TSHR P16473 1/20 0.37
GRM5 P41594 1/20 0.37
SRC P12931 1/20 0.36
UHRF1 Q96T88 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTR2C P28335 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2B P41595 1/20 0.34
ADRA2A P08913 3/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
NPY5R Q15761 1/20 0.33
ADRA1A P35348 2/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1B P35368 1/20 0.33
HTR1A P08908 1/20 0.33
OPRM1 P35372 1/20 0.33
CYP2D6 P10635 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL38950 1.00 NNMT (0.44) NNMTTSHRGRM5SRCUHRF1
Hydrochloric Acid SCHEMBL21777851 0.98 NNMT (0.42) NNMTTSHRGRM5SRCUHRF1
Hydrochloric Acid SCHEMBL31063054 0.98 NNMT (0.42) NNMTTSHRGRM5SRCUHRF1
SCHEMBL2608519 0.94 TSHR (0.41) NNMTTSHRGRM5SRCL3MBTL1
SCHEMBL30903257 0.94 TSHR (0.41) NNMTTSHRGRM5SRCL3MBTL1
SCHEMBL6641301 0.89 NNMT (0.38) NNMTTSHRGRM5SRCUHRF1
SCHEMBL29376210 0.87
SCHEMBL288016 0.87
SCHEMBL29129603 0.83 NNMT (0.34) NNMT
SCHEMBL2845218 0.79 CD44 (0.39) HTR2CHTR2AHTR2BADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3768675-B1 NOVEL TRIAZOLONE DERIVATIVES OR SALTS THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME YUHAN CORP (KR) 2026-04-01 EP claimed
CN-111655695-B Substituted furopyrimidine compounds as PDE1 inhibitors 达特神经科学有限公司 2025-05-27 CN claimed
WO-2025072206-A1 INTEGRIN INHIBITORS FOR TREATMENT OF PRIMARY SCLEROSING CHOLANGITIS PLIANT THERAPEUTICS, INC. (US) 2025-04-03 WO claimed
CN-118894816-A 3, 3-Difluoroallylamine or salt thereof and pharmaceutical composition comprising the same 柳韩洋行 2024-11-05 CN claimed
CN-111886233-B Triazolone derivatives or salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-01-02 CN claimed
EP-4534084-A4 USE OF TETRAHYDRONAPHTHYRIDINE DERIVATIVE FOR PREPARING PRODUCT FOR IMPROVING HYPERPIGMENTATION SCINNOHUB PHARMACEUTICAL CO LTD (CN) 2026-05-27 EP disclosed
EP-4713313-A2 TETRAHYDRONAPTHYRIDINE AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD Springworks Therapeutics, Inc. (US) 2026-03-25 EP disclosed
EP-4713313-A2 TETRAHYDRONAPTHYRIDINE AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD Springworks Therapeutics, Inc. (US) 2026-03-25 EP disclosed
US-20260048130-A1 ALPHA-V BETA-6 (avb6) INTEGRIN LIGANDS FOR EXTRAHEPATIC DELIVERY ALNYLAM PHARMACEUTICALS INC (US) 2026-02-19 US disclosed
WO-2026017056-A1 TETRAHYDRONAPHTHYRIDINE STING INHIBITOR AND PHARMACEUTICAL USE THEREOF 中国药科大学 2026-01-22 WO disclosed
EP-4665339-A1 INHIBITING ALPHA V BETA 8 INTEGRIN Morphic Therapeutic, Inc. (US) 2025-12-24 EP disclosed
US-12497399-B2 Fluorinated integrin antagonists OCUTERRA THERAPEUTICS, INC. (US) 2025-12-16 US disclosed
WO-2022232838-A1 EXPANDED DOSAGE REGIMENS FOR INTEGRIN INHIBITORS PLIANT THERAPEUTICS, INC. (US) 2022-11-03 WO disclosed
WO-2022189856-A9 COMPOUNDS USEFUL FOR TREATING LIVER DISEASES ABIONYX PHARMA SA (FR) 2022-10-13 WO disclosed
WO-2022206800-A1 TETRAHYDRONAPHTHYRIDINE COMPOUND CRYSTAL FORM AND SALT FORM, AND PREPARATION METHODS THEREFOR 南京明德新药研发有限公司 2022-10-06 WO disclosed
WO-2022189856-A1 COMPOUNDS USEFUL FOR TREATING LIVER DISEASES ABIONYX PHARMA SA (FR) 2022-09-15 WO disclosed
WO-2022170947-A1 TETRAHYDRONAPHTHYRIDINE DERIVATIVES AS KRAS MUTANT G12C INHIBITORS, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 苏州阿尔脉生物科技有限公司 2022-08-18 WO disclosed
EP-4034236-A1 COMPOUNDS USEFUL FOR TREATING LIVER DISEASES Abionyx Pharma SA (FR) 2022-08-03 EP disclosed
US-11292802-B2 Substituted tetrahydropyrrolo[1,2-a]pyrazines as alpha v integrin inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2022-04-05 US disclosed
EP-3952902-A1 DOSAGE FORMS AND REGIMENS FOR AMINO ACID COMPOUNDS Pliant Therapeutics, Inc. (US) 2022-02-16 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-20260048130-A1 ALPHA-V BETA-6 (avb6) INTEGRIN LIGANDS FOR EXTRAHEPATIC DELIVERY ITGB6, ITGA6, ITGA2B NNMT 3458/4885TSHR 1352/4885GRM5 2048/4885
US-11292802-B2 Substituted tetrahydropyrrolo[1,2-a]pyrazines as alpha v integrin inhibitors ITGB1, ITGAV, ITGA1 NNMT 3187/4885TSHR 2159/4885GRM5 601/4885
US-12497399-B2 Fluorinated integrin antagonists ITGB5, ITGB1, ITGA5 NNMT 3420/4885TSHR 474/4885GRM5 1451/4885

“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.