SCHEMBL6366338

SCHEMBL6366338

CC(Cc1cc(CO)cc(=O)[nH]1)CC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 5/20 0.36

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
SCHEMBL4660603 0.81 GPR84 (0.33) GPR84
Monoethanolamine SCHEMBL20602874 0.79 GPR84 (0.32) GPR84
SCHEMBL4286679 0.72 GPR84 (0.42) GPR84
SCHEMBL794919 0.71 PARP1 (0.31)
SCHEMBL8884531 0.69 MPO (0.53) GPR84
Monoethanolamine SCHEMBL5374537 0.68 PARP1 (0.30)
SCHEMBL19583321 0.66 MAPT (0.32)
SCHEMBL1170468 0.64 PRKCA (0.34) GPR84
SCHEMBL6695551 0.63 GPR84 (0.69) GPR84
SCHEMBL8505208 0.62 KDM4E (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030086881-A1 Antiinfective combinations and their use for the topical treatment of fungal infections of the toenails and fingernails AVENTIS PHARMA DEUTSCHLAND GMBH 2003-05-08 US claimed
US-20010046478-A1 Antiinfective combinations and their use for the topical treatment of fungal infections of the toenails and fingernails AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-11-29 US claimed
EP-0315912-B1 SEBOSUPPRESSIVE PREPARATIONS Henkel Kommanditgesellschaft auf Aktien (DE) 1992-06-17 EP claimed
US-20180296459-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS BASF SE (DE) 2018-10-18 US disclosed
EP-3378313-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS BASF SE (DE) 2018-09-26 EP disclosed
EP-2688405-B1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS BASF SE (DE) 2017-11-22 EP disclosed
EP-2688405-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS BASF SE (DE) 2014-01-29 EP disclosed
WO-2012127009-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS BASF SE (DE) 2012-09-27 WO disclosed
US-20050260238-A1 Cosmetic compositions comprising wholly hydrophilic block copolymers and particular anti-fungal agents L'OREAL (FR) 2005-11-24 US disclosed
US-20040039030-A1 Use of 1-hydroxy-2-pyridones for the treatment of seborrheic dermatitis HOECHST AKEENGESELLSCHAFT (DE) 2004-02-26 US disclosed
US-20030086881-A1 Antiinfective combinations and their use for the topical treatment of fungal infections of the toenails and fingernails AVENTIS PHARMA DEUTSCHLAND GMBH 2003-05-08 US disclosed
US-6455551-B1 TREATING FUNGAL DISORDER CAUSED BY FLUCONAZOLE RESISTANT YEAST AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-09-24 US disclosed
US-6375939-B1 ANTIDANDRUFF L'OREAL (FR) 2002-04-23 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 (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-20050260238-A1 Cosmetic compositions comprising wholly hydrophilic block copolymers and particular anti-fungal agents SCLY, SUCLG1, POLR1C GPR84 4613/4885
US-20040039030-A1 Use of 1-hydroxy-2-pyridones for the treatment of seborrheic dermatitis CYP24A1, CYP27B1, HSD3B1 GPR84 2709/4885
US-20180296459-A1 COMPOSITIONS CONTAINING POLYMERIC, IONIC COMPOUNDS COMPRISING IMIDAZOLIUM GROUPS PUF60, POLR1C, PICALM GPR84 3656/4885

“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.