SCHEMBL6002665

SCHEMBL6002665

O=C(Nc1ccc(F)cc1Cl)c1ccn(C(=O)Nc2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 9/20 0.64
TP53 P04637 1/20 0.49
ALDH1A1 P00352 1/20 0.47
ABL1 P00519 4/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GRM4 Q14833 1/20 0.42
EPHX2 P34913 1/20 0.42

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
SCHEMBL6003943 0.82 TP53 (0.53) TP53ABL1NPC1RAB9AL3MBTL1
SCHEMBL6002626 0.75 TP53 (0.52) TP53ALDH1A1ABL1NPC1RAB9A
SCHEMBL6003781 0.73 NPY5R (0.49) TP53ALDH1A1
SCHEMBL6003902 0.73 ALOX15 (0.63) ALOX15TP53ALDH1A1ABL1NPC1
SCHEMBL3989236 0.73 ALOX15 (0.94) ALOX15ALDH1A1NPC1RAB9A
SCHEMBL2907641 0.72 ALOX15 (1.00) ALOX15ALDH1A1NPC1RAB9AEPHX2
SCHEMBL6454874 0.69 ALOX15 (0.57) ALOX15
SCHEMBL6004365 0.67 ALOX15 (0.61) ALOX15TP53ALDH1A1NPC1RAB9A
SCHEMBL26697230 0.67 EPHX2 (0.64) TP53NPC1RAB9AEPHX2
SCHEMBL11012705 0.67 TDP1 (0.72) ABL1NPC1RAB9AEPHX2

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-20060183780-A1 Pyrazole compounds useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-08-17 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-20060183780-A1 Pyrazole compounds useful in the treatment of inflammation ALOX15, ALOX12, ALOX15B ALOX15 1/4885TP53 2001/4885ALDH1A1 763/4885

“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.