SCHEMBL5957075

SCHEMBL5957075

O=C(NC(O)C1CCCCC1)c1cc(-n2cc[nH]c2=O)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 10/20 0.45
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
SMYD3 Q9H7B4 1/20 0.36
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
PYGL P06737 1/20 0.34

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
SCHEMBL5838979 1.00 P2RX7 (0.45) P2RX7CNR1CNR2CCNA2CDK2
SCHEMBL6256315 0.84 HSD17B1 (0.43) P2RX7CNR1CNR2CCNA2CDK2
SCHEMBL5838554 0.84 HSD17B1 (0.49) P2RX7CNR1CNR2CCNA2CDK2
SCHEMBL5838675 0.82 P2RX7 (0.46) P2RX7CNR1CNR2HPGDSMN1; SMN2
SCHEMBL5838995 0.82 P2RX7 (0.46) P2RX7CNR1CNR2HPGDSMN1; SMN2
SCHEMBL5838150 0.82 P2RX7 (0.52) P2RX7CNR1CNR2SMYD3
SCHEMBL1412889 0.81 P2RX7 (0.69) P2RX7
SCHEMBL1412974 0.81 P2RX7 (0.69) P2RX7
SCHEMBL5837838 0.79 P2RX7 (0.40) P2RX7CNR1CNR2SMYD3HPGD
SCHEMBL5839340 0.79 P2RX7 (0.41) P2RX7CNR1CNR2CDK2SMYD3

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 1 patent. 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

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 7/4885CNR1 62/4885CNR2 117/4885

“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.