SCHEMBL5263685

SCHEMBL5263685

NC1=CN(Cc2ccccc2)Cc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
APAF1 O14727 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SIGMAR1 Q99720 2/20 0.37
ACHE P22303 1/20 0.36
MC4R P32245 1/20 0.36
ALOX15 P16050 1/20 0.35
NR3C1 P04150 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
DRD2 P14416 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 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
SCHEMBL29809367 0.80 MAPT (0.40) MAPTALDH1A1MEN1APAF1HPGD
SCHEMBL28328211 0.80 MAPT (0.40) MAPTALDH1A1MEN1APAF1HPGD
SCHEMBL26614037 0.77 ADRA2A (0.39) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL28029758 0.75 NPC1 (0.33) MAPTKMT2ASMN1; SMN2LMNANPC1
SCHEMBL9221467 0.74 NR3C1 (0.44) MAPTALDH1A1MEN1APAF1HPGD
SCHEMBL27264546 0.69 KMT2A (0.39) MAPTALDH1A1HPGDKMT2ASMN1; SMN2
SCHEMBL4436383 0.69 KMT2A (0.39) MAPTKMT2ASMN1; SMN2LMNANPC1
SCHEMBL28266989 0.69 CHRM5 (0.38) MAPTALDH1A1HPGDLMNANPC1
SCHEMBL7827660 0.67 PARP1 (0.35) MAPTALDH1A1MEN1APAF1HPGD
SCHEMBL6772339 0.67 SIGMAR1 (0.37) LMNASIGMAR1MC4R

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-20070225318-A1 Pyrazole Compounds Useful In The Treatment Of Inflammation BIOLIPOX AB (SE) 2007-09-27 US disclosed
EP-1794145-A1 PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-06-13 EP disclosed
WO-2006032851-A1 PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-03-30 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-20070225318-A1 Pyrazole Compounds Useful In The Treatment Of Inflammation ALOX15, ALOX15B, ALOX12 MAPT 4420/4885ALDH1A1 306/4885MEN1 4542/4885

“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.