SCHEMBL6303203

SCHEMBL6303203

Nc1cccc(Sc2ccc(C(=O)N[C@@H]3C[C@@H]4CCN(C4)C3)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 9/20 0.58
DRD2 P14416 2/20 0.43
DRD4 P21917 2/20 0.43
EZH2 Q15910 1/20 0.41
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
SMYD3 Q9H7B4 1/20 0.36
MGLL Q99685 1/20 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
SCHEMBL6303198 1.00 CHRNA7 (0.58) CHRNA7DRD2DRD4EZH2DDB1
SCHEMBL6310460 0.95 CHRNA7 (0.54) CHRNA7DRD2DRD4EZH2DDB1
SCHEMBL6303477 0.90 CHRNA7 (0.49) CHRNA7DRD2DRD4EZH2DDB1
SCHEMBL6304714 0.90 CHRNA7 (0.58) CHRNA7DRD2DRD4EZH2MGLL
SCHEMBL6304718 0.90 CHRNA7 (0.58) CHRNA7DRD2DRD4EZH2MGLL
SCHEMBL6303154 0.89 CHRNA7 (0.66) CHRNA7DRD2DRD4EZH2DDB1
SCHEMBL6303152 0.89 CHRNA7 (0.66) CHRNA7DRD2DRD4EZH2DDB1
SCHEMBL6310361 0.88 CHRNA7 (0.60) CHRNA7EZH2MGLL
SCHEMBL6310370 0.88 CHRNA7 (0.60) CHRNA7EZH2MGLL
SCHEMBL6311905 0.88 CHRNA7 (0.67) CHRNA7DRD2DRD4EZH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6852716-B2 Substituted-aryl compounds for treatment of disease PFIZER INC (US) 2005-02-08 US claimed
US-20030236279-A1 Substituted-aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
US-6852716-B2 Substituted-aryl compounds for treatment of disease PFIZER INC (US) 2005-02-08 US disclosed
US-20030236279-A1 Substituted-aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 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-20030236279-A1 Substituted-aryl compounds for treatment of disease NAT1, CYP7A1, CYP7B1 CHRNA7 2937/4885DRD2 3977/4885DRD4 3850/4885

“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.