SCHEMBL5770286

SCHEMBL5770286

CCCCCCCCCCN1CCN(C)CC1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 6/20 0.65
GNAO1 P09471 6/20 0.65
GNAI1 P63096 6/20 0.65
PAOX Q6QHF9 1/20 0.55
KDM4E B2RXH2 2/20 0.50
GAA P10253 1/20 0.50
LMNA P02545 1/20 0.49
ALDH1A1 P00352 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
GUSB P08236 2/20 0.47
EBP Q15125 1/20 0.47
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL11740596 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL10725884 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL4911879 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL4304828 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL10520655 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11737892 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11739399 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11739779 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11741978 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11740614 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103588948-A Soft biodegradable high-resilience polyurethane foaming plastic ANHUI HUAIHUA CHEMICAL GROUP 2014-02-19 CN claimed
CN-101426855-A Composition for preparing a biodegradable polyurethane- based foam and a biodegradable polyurethane foam PHB IND SA (BR) 2009-05-06 CN claimed
CN-101389677-A Composition for preparing a degradable polyol polyester, process for obtaining a polyol polyester, an elastomer, foams, paints and adhesives, and a degradable polyol polyester foam PHB IND SA (BR) 2009-03-18 CN claimed
EP-1673089-A2 PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS Vertex Pharmaceuticals Incorporated (US) 2006-06-28 EP claimed
WO-2005030188-A2 PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2005-04-07 WO claimed
US-4057413-A Methods and compositions for regulating plant growth using piperazine compounds BAYER AKTIENGESELLSCHAFT (DT) 1977-11-08 US claimed
WO-2024181373-A1 METHOD FOR SELECTIVELY MODIFYING SUBSTRATE SURFACE, METHOD FOR PRODUCING SURFACE-TREATED SUBSTRATE, AND COMPOSITION JSR株式会社 2024-09-06 WO disclosed
US-11312700-B2 Aryl cyclopropyl-amino-isoquinolinyl amide compounds AERIE PHARMACEUTICALS, INC. (US) 2022-04-26 US disclosed
US-10968198-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor YALE UNIVERSITY (US) 2021-04-06 US disclosed
US-20210002253-A1 ARYL CYCLOPROPYL-AMINO-ISOQUINOLINYL AMIDE COMPOUNDS ALCON INC. (CH) 2021-01-07 US disclosed
US-20190276425-A1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR UNIV YALE (US) 2019-09-12 US disclosed
CN-103588948-A Soft biodegradable high-resilience polyurethane foaming plastic ANHUI HUAIHUA CHEMICAL GROUP 2014-02-19 CN disclosed
CN-102492109-A Biodegradable high-resilience flexible polyurethane foam plastics and its preparation method UNIV XI AN SCI & TECHNOLOGY 2012-06-13 CN disclosed
CN-101426855-A Composition for preparing a biodegradable polyurethane- based foam and a biodegradable polyurethane foam PHB IND SA (BR) 2009-05-06 CN disclosed
EP-1673089-A2 PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS Vertex Pharmaceuticals Incorporated (US) 2006-06-28 EP disclosed
WO-2005030188-A2 PHENYL-PIPERAZINE DERIVATIVES AS MODULATORS OF MUSCARINIC RECEPTORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2005-04-07 WO disclosed
US-4057413-A Methods and compositions for regulating plant growth using piperazine compounds BAYER AKTIENGESELLSCHAFT (DT) 1977-11-08 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 (4 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-10968198-B2 Biaryltriazole inhibitors of macrophage migration inhibitory factor MIF, MMP12, CSF1R GNAI3 112/4885GNAO1 1401/4885GNAI1 262/4885
US-20210002253-A1 ARYL CYCLOPROPYL-AMINO-ISOQUINOLINYL AMIDE COMPOUNDS UACA, HRAS, MYLK GNAI3 83/4885GNAO1 537/4885GNAI1 71/4885
US-11312700-B2 Aryl cyclopropyl-amino-isoquinolinyl amide compounds UACA, HRAS, MYLK GNAI3 83/4885GNAO1 537/4885GNAI1 71/4885
US-20190276425-A1 BIARYLTRIAZOLE INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR MIF, MMP12, CSF1R GNAI3 112/4885GNAO1 1401/4885GNAI1 262/4885

“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.