SCHEMBL6510133

SCHEMBL6510133

CCCOc1ccc(-n2cc(NC(N)=O)c(C(=O)NCc3ccc(OC)cc3)n2)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.44
KMT2A Q03164 5/20 0.44
MEN1 O00255 3/20 0.43
HDAC1 Q13547 2/20 0.43
MAPT P10636 2/20 0.42
TP53 P04637 2/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM4C Q9H3R0 1/20 0.41
POLB P06746 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
RPA1 P27694 2/20 0.41
ALOX15 P16050 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL6504429 0.88 KMT2A (0.49) ABCB1KMT2AMEN1HDAC1MAPT
SCHEMBL6498598 0.86 KMT2A (0.53) ABCB1KMT2AMEN1HDAC1MAPT
SCHEMBL6501117 0.83 MAPT (0.45) KMT2AMEN1MAPTLMNAALDH1A1
SCHEMBL6501019 0.83 RXFP1 (0.54) ABCB1KMT2AMEN1HDAC1MAPT
SCHEMBL6497717 0.82 KDM4C (0.49) KMT2AMEN1MAPTTP53LMNA
SCHEMBL6500262 0.81 KMT2A (0.48) ABCB1KMT2AMEN1HDAC1LMNA
SCHEMBL6504732 0.80 HDAC1 (0.48) ABCB1KMT2AMEN1HDAC1MAPT
SCHEMBL6506101 0.80 KMT2A (0.52) ABCB1KMT2AMEN1HDAC1TP53
SCHEMBL6504903 0.78 KMT2A (0.49) ABCB1KMT2AMEN1HDAC1ALDH1A1
SCHEMBL6504692 0.76 HDAC1 (0.47) ABCB1KMT2AMEN1HDAC1MAPT

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-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation PHARMACIA AND UPJOHN COMPANY LLC 2005-09-08 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-20050197338-A1 Substituted pyrazole urea compounds for the treatment of inflammation IL4, ARG2, CASP4 ABCB1 1277/4885KMT2A 3219/4885MEN1 4599/4885

“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.