Sugi Predict

Sugi Predict / Compounds / SCHEMBL560649

SCHEMBL560649

SCHEMBL560649

C#Cc1ccc(N(CCCC)CCCC)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.41
▸ ERBB2 P04626 1/20 0.41
▸ CNR2 P34972 1/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ CHRM4 P08173 1/20 0.38
▸ CHRM5 P08912 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ CHRM3 P20309 1/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ NR1H2 P55055 5/20 0.36
▸ NR1H3 Q13133 5/20 0.36
▸ AR P10275 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ SLC16A3 O15427 1/20 0.34
▸ SLC16A1 P53985 1/20 0.34

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
SCHEMBL29768271 0.93 KCNH2 (0.39) EGFRERBB2CNR2CYP2C9
SCHEMBL10027405 0.93 KCNH2 (0.39) EGFRERBB2CNR2CYP2C9
SCHEMBL2829398 0.93 KCNH2 (0.39) EGFRERBB2CNR2CYP2C9
SCHEMBL2829021 0.88 PTPN11 (0.43) EGFRERBB2CNR2CYP2C9
SCHEMBL5136014 0.86 CNR2 (0.43) CNR2KDM4E
SCHEMBL7153351 0.83 EGFR (0.50) EGFRERBB2CNR2CHRM2CHRM4
SCHEMBL19543257 0.83 MAPT (0.51) CYP2C9KDM4EALDH1A1MAPT
SCHEMBL156302 0.81 TSHR (0.46) EGFRERBB2CNR2CHRM2CHRM4
SCHEMBL2704042 0.81 EGFR (0.44) EGFRERBB2CNR2CHRM2CHRM4
SCHEMBL1099561 0.79 ALDH1A1 (0.52) CNR2CYP2C9KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114853685-B Broadband liquid crystal laser protection material prepared by multi-click chemistry and preparation method thereof 西北工业大学 2024-05-14 — — CN claimed
CN-116375984-A Water-soluble conjugated high-molecular polymer and preparation method thereof 西京学院 2023-07-04 — — CN claimed
CN-114853685-A Broadband liquid crystal laser protection material prepared by multi-click chemistry and preparation method thereof 西北工业大学 2022-08-05 — — CN claimed
CN-112175171-B Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 苏州希夫安材料科技有限公司 2022-07-05 — — CN claimed
CN-111718487-B Preparation method of click-modified polysiloxane side chain liquid crystal polymer 苏州美嘉写智能显示科技有限公司 2022-01-28 — — CN claimed
CN-112175171-A Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 南京优写智能科技有限公司 2021-01-05 — — CN claimed
CN-111944327-A Near-infrared absorption dye applied to liquid crystal system and preparation method thereof 南京优写智能科技有限公司 2020-11-17 — — CN claimed
CN-111718487-A Preparation method of click-modified polysiloxane side chain liquid crystal polymer 苏州美嘉写智能显示科技有限公司 2020-09-29 — — CN claimed
CN-114853685-B Broadband liquid crystal laser protection material prepared by multi-click chemistry and preparation method thereof 西北工业大学 2024-05-14 — — CN disclosed
CN-116375984-A Water-soluble conjugated high-molecular polymer and preparation method thereof 西京学院 2023-07-04 — — CN disclosed
CN-114853685-A Broadband liquid crystal laser protection material prepared by multi-click chemistry and preparation method thereof 西北工业大学 2022-08-05 — — CN disclosed
CN-112175171-B Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 苏州希夫安材料科技有限公司 2022-07-05 — — CN disclosed
CN-111718487-B Preparation method of click-modified polysiloxane side chain liquid crystal polymer 苏州美嘉写智能显示科技有限公司 2022-01-28 — — CN disclosed
CN-111718487-B Preparation method of click-modified polysiloxane side chain liquid crystal polymer 苏州美嘉写智能显示科技有限公司 2022-01-28 — — CN disclosed
US-20100152338-A1 NONLINEAR OPTICAL MATERIAL COMPOSITION AND METHOD OF MANUFACTURE NITTO DENKO CORPORATION (JP) 2010-06-17 — — US disclosed
WO-2009109546-A1 PHOTOCHROMIC DICHROIC NAPHTHO-PYRANS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2009-09-11 — — WO disclosed
EP-2098520-A1 Photochromic dichroic naphtho-pyrans and optical articles containing them Essilor International (Compagnie Générale D'Optique) (FR) 2009-09-09 — — EP disclosed
EP-2098520-A1 Photochromic dichroic naphtho-pyrans and optical articles containing them Essilor International (Compagnie Générale D'Optique) (FR) 2009-09-09 — — EP disclosed
US-20080223444-A1 Perylene Charge-Transport Materials, Methods of Fabrication Thereof, and Methods of Use Thereof GEORGIA TECH RESEARCH CORPORATION 2008-09-18 — — US disclosed
WO-2005124453-A2 PERYLENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2005-12-29 — — WO 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 (2 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-20100152338-A1 NONLINEAR OPTICAL MATERIAL COMPOSITION AND METHOD OF MANUFACTURE C5, OR10J3, C1S EGFR 1350/4885ERBB2 872/4885CNR2 255/4885
US-20080223444-A1 Perylene Charge-Transport Materials, Methods of Fabrication Thereof, and Methods of Use Thereof SLC43A1, SLC3A2, SLC16A3 EGFR 2898/4885ERBB2 3912/4885CNR2 1575/4885

“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.