SCHEMBL769669

SCHEMBL769669

N#Cc1cccc(Br)c1C#N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.40
HIF1A Q16665 1/20 0.40
TSHR P16473 1/20 0.39
LMNA P02545 2/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
TLR8 Q9NR97 1/20 0.35
MCL1 Q07820 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
CACNA1B Q00975 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
SCHEMBL1343169 0.85 DYRK1A (0.42) DYRK1ATSHRLMNAALDH1A1MAPT
SCHEMBL20911599 0.85 DYRK1A (0.38) DYRK1ASMN1; SMN2HIF1ATSHRLMNA
SCHEMBL16953469 0.85 DYRK1A (0.38) DYRK1ASMN1; SMN2HIF1ATSHRLMNA
SCHEMBL645262 0.82 TSHR (0.48) SMN1; SMN2HIF1ATSHRCA1CA2
SCHEMBL28295603 0.78 TDP1 (0.39) DYRK1ASMN1; SMN2HIF1ATSHRALDH1A1
SCHEMBL31032883 0.78 DYRK1A (0.47) DYRK1ATSHRLMNACA1CA2
SCHEMBL3386194 0.78 DYRK1A (0.47) DYRK1ATSHRLMNACA1CA2
SCHEMBL136719 0.77
SCHEMBL30201156 0.77
SCHEMBL17818517 0.77 TSHR (0.50) DYRK1ATSHRLMNACA1CA2

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-119330339-A Method for preparing porous carbon based on synchronous synthesis of nitrile resin/graphene nanosheets and porous carbon material 成都大学 2025-01-21 CN claimed
CN-111875794-A Novel preparation method of nitrile resin monomer 成都大学 2020-11-03 CN claimed
CN-119330339-A Method for preparing porous carbon based on synchronous synthesis of nitrile resin/graphene nanosheets and porous carbon material 成都大学 2025-01-21 CN disclosed
WO-2023136136-A1 COMPOUND AND COLORED RESIN COMPOSITION 住友化学株式会社 2023-07-20 WO disclosed
CN-116082231-A Rapid preparation method and application of 3-aminoquinoline derivative 精华制药集团南通有限公司 2023-05-09 CN disclosed
CN-114890963-B Benzylidene thiazolidinedione derivative, and preparation method and application thereof 湖州师范学院 2023-05-05 CN disclosed
CN-108148055-B D-pi-A type organic fluorescent material based on naphthalene and preparation method thereof 陕西师范大学 2021-04-13 CN disclosed
CN-111875794-A Novel preparation method of nitrile resin monomer 成都大学 2020-11-03 CN disclosed
US-20120068123-A1 USE OF PHTHALOCYANINE COMPOUNDS WITH ARYL OR HETARYL SUBSTITUENTS IN ORGANIC SOLAR CELLS BASF SE (DE) 2012-03-22 US disclosed
US-7442696-B2 Mineralocorticoid receptor modulator compounds, processes for their preparation, and their uses LIGAND PHARMACEUTICALS, INC. (US) 2008-10-28 US disclosed
US-20070197520-A1 MINERALOCORTICOID RECEPTOR MODULATOR COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USES LIGAND PHARMACEUTICALS INC. 2007-08-23 US disclosed
WO-2006010142-A2 MINERALOCORTICOID RECEPTOR MODULATOR COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE LIGAND PHARMACEUTICALS, INC. (US) 2006-01-26 WO disclosed
US-5776576-A Phthalaocyanine compound as a layer in optical recording medium Shirai, Hirofusa (JP) 1998-07-07 US disclosed
US-5618930-A PHTHALOCYANINE COMPOUNDS HAVING IMPROVED SOLUBILITY AND HIGH PURITY Shirai, Hirofusa (JP) 1997-04-08 US disclosed
US-5516900-A IMPROVED SOLUBILITY AND PURITY Shirai, Hirofusa (JP) 1996-05-14 US disclosed
US-5262052-A Separation of polycyclic aromatic hydrocarbons BRIGHAM YOUNG UNIVERSITY (US) 1993-11-16 US disclosed
US-4239686-A Process for producing phthalimido derivatives ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1980-12-16 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 (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-20120068123-A1 USE OF PHTHALOCYANINE COMPOUNDS WITH ARYL OR HETARYL SUBSTITUENTS IN ORGANIC SOLAR CELLS RB1, NRAS, HLA-B DYRK1A 2265/4885SMN1; SMN2 4626/4885HIF1A 4417/4885
US-20070197520-A1 MINERALOCORTICOID RECEPTOR MODULATOR COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USES NR3C2, MC2R, NR3C1 DYRK1A 2150/4885SMN1; SMN2 4862/4885HIF1A 3929/4885

“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.