SCHEMBL6004187

SCHEMBL6004187

O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccn(C(=O)Nc2ccc3c(c2)OCO3)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.67
MAPT P10636 6/20 0.47
LMNA P02545 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HTT P42858 2/20 0.47
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 3/20 0.46
POLB P06746 2/20 0.46
HPGD P15428 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TSHR P16473 1/20 0.46
RAB9A P51151 8/20 0.45
NPC1 O15118 7/20 0.45
PKM P14618 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43
RXFP2 Q8WXD0 1/20 0.42
RXFP1 Q9HBX9 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
SCHEMBL6004189 0.89 ALOX15 (0.66) ALOX15MAPTLMNASMN1; SMN2HTT
SCHEMBL6004355 0.84 TSHR (0.51) ALOX15MAPTALDH1A1HPGDMEN1
SCHEMBL6004357 0.83 ALOX15 (0.74) ALOX15MAPTSMN1; SMN2HTTMAPK1
SCHEMBL6004044 0.83 ALOX15 (0.74) ALOX15MAPTLMNASMN1; SMN2HTT
SCHEMBL6003902 0.77 ALOX15 (0.63) ALOX15MAPTLMNASMN1; SMN2MAPK1
SCHEMBL6004808 0.72 ALOX15 (0.56) ALOX15MAPTSMN1; SMN2HTTMAPK1
SCHEMBL5899249 0.69 KDR (0.60) RAB9ANPC1PKM
SCHEMBL6004374 0.67 ALOX15 (0.61) ALOX15MAPTSMN1; SMN2HTTMAPK1
SCHEMBL10220635 0.66 CCR2 (0.74) MAPTLMNASMN1; SMN2HTTMAPK1
SCHEMBL14082719 0.64 AHR (0.58) MAPTLMNASMN1; SMN2ALDH1A1MEN1

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 3 patents. 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
EP-1603897-A1 PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2005-12-14 EP disclosed
WO-2004080999-A1 PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2004-09-23 WO 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 1/4885MAPT 4328/4885LMNA 2393/4885

“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.