SCHEMBL5839202

SCHEMBL5839202

CN(C)CC(O)Cn1ccn(-c2ccc(Cl)c(C(=O)NC(O)C3CCCCCC3)c2)c1=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 9/20 0.38
CNR2 P34972 3/20 0.34
CNR1 P21554 2/20 0.34
TSHR P16473 1/20 0.33
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
METAP2 P50579 1/20 0.31
SMYD3 Q9H7B4 1/20 0.31
DRD2 P14416 1/20 0.31

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
SCHEMBL5837733 0.90 P2RX7 (0.40) P2RX7CNR2CNR1HPGDSMN1; SMN2
SCHEMBL5837666 0.89 P2RX7 (0.39) P2RX7CNR2CNR1METAP2SMYD3
SCHEMBL5838594 0.88 P2RX7 (0.45) P2RX7CNR2CNR1HPGDSMN1; SMN2
SCHEMBL5837257 0.88 DRD2 (0.40) P2RX7CNR2CNR1MEN1KMT2A
SCHEMBL5837167 0.86 P2RX7 (0.39) P2RX7CNR2CNR1TSHRHPGD
SCHEMBL5838903 0.85 P2RX7 (0.37) P2RX7CNR2CNR1TSHRSMYD3
SCHEMBL5839340 0.84 P2RX7 (0.41) P2RX7CNR2CNR1HPGDSMN1; SMN2
SCHEMBL5837636 0.83 P2RX7 (0.39) P2RX7CNR2CNR1TSHRHPGD
SCHEMBL5838616 0.83 P2RX7 (0.40) P2RX7CNR2CNR1HPGDSMN1; SMN2
SCHEMBL6260746 0.83 P2RX7 (0.34) P2RX7CNR2CNR1SMYD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060217430-A1 Benzamide inhibitors of the P2X7 receptor DOMBROSKI MARK A 2006-09-28 US disclosed
US-7071223-B1 Benzamide inhibitors of the P2X7 receptor PFIZER, INC. (US) 2006-07-04 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-20060217430-A1 Benzamide inhibitors of the P2X7 receptor IL1R1, P2RY1, P2RX1 P2RX7 7/4885CNR2 117/4885CNR1 62/4885

“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.