Neocuproine

Neocuproine

SCHEMBL31709522

Cc1ccc2ccc3ccc(C)nc3c2n1.O

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Neocuproine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 known ✓ P09874 1/20 0.47
OPRK1 known ✓ P41145 1/20 0.43
MEN1 known ✓ O00255 4/20 0.39
AGTR1 known ✓ P30556 1/20 0.39
CCR1 P32246 2/20 0.94
RAB9A P51151 1/20 0.94
CCR5 P51681 1/20 0.94
METAP2 P50579 1/20 0.56
CYP1A2 P05177 3/20 0.46
GLO1 Q04760 2/20 0.44
KMT2A Q03164 5/20 0.43
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CASP6 P55212 1/20 0.39
CCR8 P51685 1/20 0.39
SLC40A1 Q9NP59 2/20 0.39
PAX8 Q06710 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.38

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
Neocuproine SCHEMBL229136 1.00 CCR1 (0.94) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL6082081 0.97 CCR1 (0.88) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL30183159 0.97 CCR1 (0.88) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL11672280 0.97 CCR1 (1.00) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL29367091 0.97 CCR1 (1.00) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL29639703 0.97 CCR1 (1.00) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL124563 0.97 CCR1 (1.00) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL5385744 0.94 CCR1 (0.94) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL10373258 0.94 CCR1 (0.94) CCR1RAB9ACCR5METAP2PARP1
Neocuproine SCHEMBL1462062 0.94 CCR1 (0.94) CCR1RAB9ACCR5METAP2PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250327028-A1 ENGINEERED PLATELETS AS TARGETED PROTEIN DEGRADERS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2025-10-23 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 (1 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-20250327028-A1 ENGINEERED PLATELETS AS TARGETED PROTEIN DEGRADERS HSP90B1, HSP90AB1, HSP90AA1 PARP1 2391/4885OPRK1 4547/4885MEN1 3003/4885

“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.