SCHEMBL6101892

SCHEMBL6101892

CCCC1CCc2sccc2C1=NO

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
HTR2C P28335 8/20 0.36
DRD2 P14416 5/20 0.35
DRD3 P35462 5/20 0.35
NOS2 P35228 1/20 0.32
GRIN2B Q13224 1/20 0.30

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
SCHEMBL6101886 1.00 USP2 (0.41) USP2HTR2CDRD2DRD3NOS2
SCHEMBL3842816 0.80 HTR2C (0.51) HTR2CDRD2DRD3NOS2
SCHEMBL6100478 0.70 HTR2C (0.47) HTR2CDRD2DRD3NOS2
SCHEMBL9865315 0.69 USP2 (0.44) USP2NOS2
SCHEMBL8195082 0.65 NOS2 (0.49) DRD2DRD3NOS2
SCHEMBL11937074 0.64 CYP19A1 (0.55) DRD2DRD3
SCHEMBL9385024 0.64 HTR2C (0.47) HTR2C
SCHEMBL9836578 0.63 HTR2C (0.47) HTR2C
SCHEMBL11777289 0.63 HCAR2 (0.36)
SCHEMBL11777296 0.63 HCAR2 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7041672-B2 Substituted aryl 1, 4-pyrazine derivatives PFIZER INC. (US) 2006-05-09 US disclosed
US-6992087-B2 Substituted aryl 1,4-pyrazine derivatives PFIZER INC (US) 2006-01-31 US disclosed
US-20050049257-A1 Substituted aryl 1, 4-pyrazine derivatives PFIZER INC 2005-03-03 US disclosed
EP-1446387-A1 SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2004-08-18 EP disclosed
US-20030144297-A1 Substituted aryl 1,4-pyrazine derivatives PHARMACIA & UPJOHN COMPANY 2003-07-31 US disclosed
WO-2003045924-A1 SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-06-05 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-20050049257-A1 Substituted aryl 1, 4-pyrazine derivatives HTR2C, HTR4, HTR5A USP2 2734/4885HTR2C 1/4885DRD2 33/4885
US-20030144297-A1 Substituted aryl 1,4-pyrazine derivatives HTR2C, HTR4, HTR5A USP2 2734/4885HTR2C 1/4885DRD2 33/4885

“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.