SCHEMBL1850342

SCHEMBL1850342

O=C(Nc1cccc(Oc2ccccc2)c1)Nc1cccc(-c2n[nH]cc2-c2ccncc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 2/20 0.52
EPHB4 P54760 1/20 0.49
ALDH1A1 P00352 2/20 0.48
BTK Q06187 1/20 0.48
IGF1R P08069 3/20 0.47
DYRK1A Q13627 1/20 0.47
CNR1 P21554 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
KDR P35968 2/20 0.46
MAPK14 Q16539 2/20 0.45
BRAF P15056 1/20 0.45
TNNI3K Q59H18 1/20 0.45
FLT1 P17948 1/20 0.45
TEK Q02763 1/20 0.45
MGLL Q99685 1/20 0.45
RIPK1 Q13546 1/20 0.45
GRK2 P25098 1/20 0.44

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
SCHEMBL1847495 0.95 RAF1 (0.56) RAF1EPHB4ALDH1A1BTKIGF1R
SCHEMBL1847629 0.91 CNR1 (0.55) ALDH1A1IGF1RCNR1KDRMAPK14
SCHEMBL1846752 0.89 ALDH1A1 (0.63) RAF1EPHB4ALDH1A1DYRK1ACNR1
SCHEMBL1848777 0.88 CNR1 (0.58) ALDH1A1IGF1RCNR1MAPK14MGLL
SCHEMBL1847348 0.86 CNR1 (0.53) RAF1EPHB4ALDH1A1CNR1KDR
SCHEMBL1845707 0.85 TAAR1 (0.51) DYRK1ACNR1KDRFLT1MGLL
SCHEMBL1846600 0.85 MEN1 (0.60) ALDH1A1IGF1RCNR1KDRMAPK14
SCHEMBL1850211 0.85 SMN1; SMN2 (0.60) DYRK1ACNR1KDRFLT1RIPK1
SCHEMBL1851742 0.84 CNR1 (0.47) ALDH1A1DYRK1ACNR1MAPK14MGLL
SCHEMBL1851325 0.84 RAF1 (0.56) RAF1ALDH1A1DYRK1ACNR1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946250-B2 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-02-03 US disclosed
US-8946250-B2 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-02-03 US disclosed
US-20140005150-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2014-01-02 US disclosed
US-8541575-B2 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-09-24 US disclosed
US-8541575-B2 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-09-24 US disclosed
EP-2324008-B1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2012-05-09 EP disclosed
US-20110144068-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-06-16 US disclosed
US-20110144068-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-06-16 US disclosed
EP-2324008-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-05-25 EP disclosed
WO-2010010154-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-01-28 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 (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-20140005150-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS MAP3K3, MAP3K19, MAP3K15 RAF1 143/4885EPHB4 2492/4885ALDH1A1 2810/4885
US-20110144068-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS MAP3K3, MAP3K19, MAP3K15 RAF1 143/4885EPHB4 2492/4885ALDH1A1 2810/4885

“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.