SCHEMBL2915869

SCHEMBL2915869

Cc1c(C(=O)O)nn(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.63
CYP2C19 P33261 3/20 0.63
CYP1A2 P05177 1/20 0.63
CNR1 P21554 2/20 0.62
CNR2 P34972 2/20 0.62
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
KDM4E B2RXH2 1/20 0.56
MAPK1 P28482 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 2/20 0.53
CYP3A4 P08684 2/20 0.53
MAPT P10636 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HTT P42858 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
PTGER1 P34995 2/20 0.51

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
SCHEMBL18353073 0.91 CNR1 (0.54) CYP2C9CYP2C19CYP1A2CNR1CNR2
SCHEMBL16197705 0.90 CNR1 (0.57) CYP2C9CYP2C19CYP1A2CNR1CNR2
SCHEMBL29838955 0.90 CYP1A2 (0.57) CYP2C9CYP2C19CYP1A2CNR1CNR2
SCHEMBL30936703 0.88 CNR1 (0.60) CYP2C9CYP2C19CYP1A2CNR1CNR2
SCHEMBL2918377 0.87 CNR1 (0.51) CYP2C9CYP2C19CYP1A2CNR1CNR2
SCHEMBL25197049 0.86 MDM2 (0.62) CYP2C9CYP2C19CYP1A2CNR1CNR2
SCHEMBL277784 0.83 CNR1 (0.62) CYP1A2CNR1CNR2CA1CA2
SCHEMBL2919412 0.83 ALDH1A1 (0.73) CYP2C9CYP2C19CYP1A2CNR1CNR2
Hydrochloric Acid SCHEMBL278149 0.82 CNR1 (0.61) CYP1A2CNR1CNR2CA1CA2
SCHEMBL253744 0.81 KDM4E (0.60) CYP2C9CYP2C19CYP1A2KDM4EMAPK1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024092205-A1 INHIBITION OF SHIP1 AS A THERAPEUTIC STRATEGY FOR THE TREATMENT OF ALZHEIMER'S DISEASE THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-05-02 WO disclosed
EP-1591443-B1 PYRAZOLE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2010-08-25 EP disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-7358371-B2 Process for the preparation of 1,5—carboxylic acid derivatives SANOFI-AVENTIS (FR) 2008-04-15 US disclosed
US-20070099978-A1 Process for the preparation of 1,5 - carboxylic acid derivatives SANOFI-AVENTIS (FR) 2007-05-03 US disclosed
US-20060128685-A1 Pyrazole derivative DAIICHI PHARMACEUTICAL CO., LTD., (JP) 2006-06-15 US disclosed
EP-1591443-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-02 EP 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 (2 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-20060128685-A1 Pyrazole derivative PTGS1, PTGS2, PTGER1 CYP2C9 251/4885CYP2C19 129/4885CYP1A2 176/4885
US-20070099978-A1 Process for the preparation of 1,5 - carboxylic acid derivatives CNR1, CNR2, MALT1 CYP2C9 619/4885CYP2C19 832/4885CYP1A2 967/4885

“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.