SCHEMBL5956561

SCHEMBL5956561

Cc1cccc(C(=O)Cc2ccnc(-c3ccc(OCC(N)=O)cc3)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 3/20 0.43
LOXL2 Q9Y4K0 2/20 0.37
IRAK4 Q9NWZ3 1/20 0.37
WNT3A P56704 1/20 0.37
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
P2RX7 Q99572 1/20 0.36
TGFBR1 P36897 1/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
MAPT P10636 1/20 0.35
PRF1 P14222 1/20 0.35

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
SCHEMBL5956440 0.87 WNT3A (0.43) WNT3AADORA2AADORA1MAPT
SCHEMBL5956384 0.84 SCN10A (0.47) WNT3APPARDADORA3
SCHEMBL5956662 0.82 LOXL2 (0.55) LOXL2IRAK4WNT3ATGFBR1
SCHEMBL5956490 0.82 WNT3A (0.39) LOXL2IRAK4WNT3AP2RX7TGFBR1
SCHEMBL5956629 0.81 TGFBR1 (0.47) LOXL2WNT3AP2RX7TGFBR1MEN1
SCHEMBL5956502 0.81 PRKAB2 (0.47) TGFBR1
SCHEMBL5956453 0.80 TGFBR1 (0.45) LOXL2WNT3ATGFBR1
SCHEMBL5956595 0.80 ACACA (0.43) ACACATGFBR1TSHRMEN1KMT2A
SCHEMBL5956509 0.79 IRAK4 (0.41) LOXL2IRAK4WNT3AP2RX7TGFBR1
SCHEMBL5790926 0.76 HDAC1 (0.46) WNT3AADORA2AADORA1MAPT

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-20060004051-A1 Compounds DODIC NERINA 2006-01-05 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-20060004051-A1 Compounds SMAD3, SMAD2, TGFBR1 ACACA 1480/4885LOXL2 758/4885IRAK4 278/4885

“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.