SCHEMBL6524348

SCHEMBL6524348

CC1=C(C(=O)O)C(c2cccc(Cl)c2)N(CCCN(C)c2ccccc2C(=O)c2ccc(N3C(=O)c4ccccc4C3=O)cc2)C(=O)N1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADCY2 Q08462 1/20 0.36
CCR1 P32246 1/20 0.35
FFAR1 O14842 1/20 0.35
HTT P42858 2/20 0.35
TP53 P04637 2/20 0.34
MAPT P10636 2/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CACNA1B Q00975 2/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
SCN2A Q99250 1/20 0.34
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33

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
SCHEMBL5568267 0.87 HTT (0.39) ADCY2CCR1FFAR1HTTTP53
SCHEMBL6524338 0.83 MAPT (0.38) ADCY2CCR1FFAR1HTTTP53
SCHEMBL5568264 0.81 ADRA1D (0.39) ADCY2CCR1FFAR1HTTTP53
SCHEMBL5562887 0.78 HTT (0.43) HTTMAPTCACNA1BADRA1DADRA1A
SCHEMBL5568028 0.74 HTT (0.40) HTTCACNA1BADRA1DADRA1AADRA1B
SCHEMBL5567175 0.73 HTT (0.40) CCR1HTTMAPTCACNA1BADRA1D
SCHEMBL5564795 0.73 HTT (0.41) HTTCACNA1BUSP2ADRA1DADRA1A
SCHEMBL5563519 0.73 MAPT (0.41) CCR1HTTMAPTTSHRLMNA
SCHEMBL5567824 0.73 HTT (0.39) HTTMAPTCACNA1BADRA1DADRA1A
SCHEMBL5563145 0.73 CACNA1B (0.43) HTTTP53MAPTTSHRCACNA1B

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-20050043339-A1 Dihydropyrimidone inhibitors of calcium channel function BRISTOL-MYERS SQUIBB COMPANY 2005-02-24 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-20050043339-A1 Dihydropyrimidone inhibitors of calcium channel function CACNA1E, CACNA1C, CACNA1S ADCY2 712/4885CCR1 3435/4885FFAR1 983/4885

“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.