SCHEMBL6309595

SCHEMBL6309595

CC(=O)c1cccc(Sc2ccc(C(=O)N[C@@H]3C[C@@H]4CCN(C4)C3)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 8/20 0.57
SMYD3 Q9H7B4 1/20 0.43
EZH2 Q15910 1/20 0.43
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MMP2 P08253 1/20 0.38
MGLL Q99685 2/20 0.37
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL6309584 1.00 CHRNA7 (0.57) CHRNA7SMYD3EZH2ALDH1A1HPGD
SCHEMBL6305755 0.95 CHRNA7 (0.53) CHRNA7SMYD3EZH2ALDH1A1HPGD
SCHEMBL6304718 0.91 CHRNA7 (0.58) CHRNA7EZH2MGLLDRD2DRD4
SCHEMBL6304714 0.91 CHRNA7 (0.58) CHRNA7EZH2MGLLDRD2DRD4
SCHEMBL6306336 0.90 CHRNA7 (0.66) CHRNA7EZH2ALDH1A1HPGDMMP2
SCHEMBL6306329 0.90 CHRNA7 (0.66) CHRNA7EZH2ALDH1A1HPGDMMP2
SCHEMBL6303529 0.89 CHRNA7 (0.54) CHRNA7SMYD3EZH2
SCHEMBL6310361 0.88 CHRNA7 (0.60) CHRNA7EZH2MGLL
SCHEMBL6310370 0.88 CHRNA7 (0.60) CHRNA7EZH2MGLL
SCHEMBL6311905 0.87 CHRNA7 (0.67) CHRNA7EZH2DRD2DRD4

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 2937/4885SMYD3 4770/4885EZH2 4701/4885

“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.