SCHEMBL6076876

SCHEMBL6076876

CONCc1ccccc1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
TAAR1 Q96RJ0 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 1/20 0.46
IDO1 P14902 2/20 0.45
MCL1 Q07820 1/20 0.45
ALDH1A1 P00352 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
SCN8A Q9UQD0 1/20 0.44
RIPK1 Q13546 1/20 0.44
MPO P05164 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 2/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL4629342 0.77 CHRM2 (0.50) LMNATAAR1KMT2AMEN1ALDH1A1
SCHEMBL6077476 0.76 IDO1 (0.48) KMT2AMEN1IDO1ALDH1A1HPGD
SCHEMBL20905599 0.76 SCN8A (0.49) LMNATAAR1L3MBTL1KMT2AMEN1
SCHEMBL6819 0.76 TAAR1 (0.63) LMNATAAR1L3MBTL1KMT2AMEN1
SCHEMBL31488449 0.75 NPC1 (0.50) LMNATAAR1L3MBTL1KMT2AMEN1
SCHEMBL11195571 0.75 NPC1 (0.50) LMNATAAR1L3MBTL1KMT2AMEN1
SCHEMBL6071681 0.75 MPO (0.60) LMNATAAR1L3MBTL1KMT2AMEN1
SCHEMBL3866918 0.73 L3MBTL1 (0.66) L3MBTL1KMT2AMCL1ALDH1A1KDM4E
SCHEMBL631227 0.72 MPO (0.58) LMNATAAR1L3MBTL1KMT2AMEN1
SCHEMBL18405086 0.72 TAAR1 (0.53) LMNATAAR1L3MBTL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240023549-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2024-01-25 US disclosed
US-20240023549-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2024-01-25 US disclosed
CN-116529235-A Fungicidal aryl amidines 科迪华农业科技有限责任公司 2023-08-01 CN disclosed
WO-2022109362-A1 FUNGICIDAL ARYL AMIDINES CORTEVA AGRISCIENCE LLC (US) 2022-05-27 WO disclosed
US-7109186-B2 4-hydroxy-5-oxo-1-(2-[4-methylpiperazin-1-yl]ethyl)-2,5-dihydro-1H-pyrrole-3-carboxylic acid (3,4-dichlorobenzyl)-methyl-amide for human immunodeficiency virus (HIV) treatment BRISTOL-MYERS SQUIBB COMPANY (US) 2006-09-19 US disclosed
CN-1617849-A HIV integrase inhibitors BRISTOL MYERS SQUIBB CO (US) 2005-05-18 CN disclosed
EP-1467695-A2 HIV INTEGRASE INHIBITORS Bristol-Myers Squibb Company (US) 2004-10-20 EP disclosed
US-6777440-B2 HIV integrase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-08-17 US disclosed
US-20040110804-A1 HIV integrase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-06-10 US disclosed
WO-2004004657-A2 HIV INTEGRASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-01-15 WO disclosed
US-20030176495-A1 HIV Integrase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2003-09-18 US disclosed
WO-2003049690-A2 HIV INTEGRASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-06-19 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 (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-20040110804-A1 HIV integrase inhibitors CDKN1A, SAMHD1, CTCF LMNA 3521/4885TAAR1 4746/4885L3MBTL1 2246/4885
US-20030176495-A1 HIV Integrase inhibitors MAPT, RIF1, HPRT1 LMNA 2590/4885TAAR1 3904/4885L3MBTL1 480/4885
US-20240023549-A1 FUNGICIDAL ARYL AMIDINES CYP1A1, CYP1A2, CYP1B1 LMNA 3813/4885TAAR1 676/4885L3MBTL1 1013/4885

“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.