SCHEMBL6003427

SCHEMBL6003427

CN(C(=O)c1ccn(C(=O)NCc2ccccc2)n1)c1ccccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
GPBAR1 Q8TDU6 1/20 0.39
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 1/20 0.39
TUBB8 Q3ZCM7 1/20 0.39
TUBA3E Q6PEY2 1/20 0.39
TUBA1A Q71U36 1/20 0.39
TUBA1C Q9BQE3 1/20 0.39
TUBB6 Q9BUF5 1/20 0.39
TUBB2B Q9BVA1 1/20 0.39
TUBB1 Q9H4B7 1/20 0.39
RAB9A P51151 4/20 0.38
KMT2A Q03164 3/20 0.38
HTT P42858 2/20 0.38

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
SCHEMBL6004838 0.84 ALOX15 (0.50) GPBAR1RAB9AKMT2AHTTSMN1; SMN2
SCHEMBL6002581 0.74 MGLL (0.41) MAPTGPBAR1RAB9AKMT2AHTT
SCHEMBL28867961 0.65 GPBAR1 (0.50) GPBAR1RAB9AKMT2AHTTSMN1; SMN2
SCHEMBL6003824 0.65 MGLL (0.43) MAPTGPBAR1RAB9AKMT2AHTT
SCHEMBL31453167 0.64 GPBAR1 (0.47) MAPTGPBAR1KMT2AMEN1
SCHEMBL1260046 0.64 ASAH1 (0.48) MAPTKDM4EALDH1A1
SCHEMBL1820107 0.63 POLB (0.50) MAPTGPBAR1SMN1; SMN2KDM4EALDH1A1
SCHEMBL616400 0.63 KMT2A (0.55) RAB9AKMT2AHTTNPC1MEN1
SCHEMBL11027751 0.62 ASAH1 (0.46) KMT2AMEN1KDM4EALDH1A1
SCHEMBL12550521 0.61 POLB (0.52) MAPTGPBAR1SMN1; SMN2KDM4EALDH1A1

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 MAPT 4328/4885GPBAR1 890/4885TUBB4A 3242/4885

“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.