SCHEMBL2415994

SCHEMBL2415994

O=C(Cc1ccccc1F)Nc1n[nH]c2sc(C(=O)Nc3ccccc3Cl)cc12

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
MEN1 O00255 1/20 0.42
RAB9A P51151 3/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
CDK2 P24941 2/20 0.40
CDK1 P06493 1/20 0.40
CDK4 P11802 1/20 0.40
EPHB3 P54753 1/20 0.39
GLS O94925 3/20 0.39
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
PARP14 Q460N5 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CCNA2 P20248 1/20 0.38
CCNA1 P78396 1/20 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
SCHEMBL2418708 0.92 RAB9A (0.42) KMT2ARAB9AMAPTNPC1ALDH1A1
SCHEMBL2422194 0.91 ALDH1A1 (0.40) KMT2AMEN1RAB9AMAPTNPC1
SCHEMBL2417616 0.89 KMT2A (0.43) KMT2AMEN1RAB9AMAPTNPC1
SCHEMBL2416285 0.87 MAPT (0.49) RAB9AMAPTNPC1LMNACDK2
SCHEMBL2415397 0.87 THRB (0.44) KMT2AMEN1RAB9AMAPTNPC1
SCHEMBL2417194 0.87 MAPT (0.48) KMT2AMEN1RAB9AMAPTNPC1
SCHEMBL2415989 0.86 MAPT (0.46) KMT2AMEN1MAPTGLSSMN1; SMN2
SCHEMBL2416128 0.86 THRB (0.43) KMT2ARAB9AMAPTNPC1ALDH1A1
SCHEMBL2422270 0.85 KCNJ5 (0.46) KMT2AMEN1RAB9AMAPTNPC1
SCHEMBL2417890 0.85 NPC1 (0.42) KMT2AMEN1RAB9AMAPTNPC1

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
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP claimed
US-8017643-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-09-13 US disclosed
US-20100286223-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors PFIZER ITALIA S.R.L. (IT) 2010-11-11 US disclosed
US-7786048-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2010-08-31 US disclosed
US-20090233813-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors PFIZER ITALIA S.R.L. (IT) 2009-09-17 US disclosed
US-7541378-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2009-06-02 US disclosed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP disclosed
US-20060122249-A1 Condensed heterocyclic pyrazole derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2006-06-08 US disclosed
EP-1530573-A1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2005-05-18 EP disclosed
WO-2004013146-A1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A (IT) 2004-02-12 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-20100286223-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors CDK2, MAP3K19, MAP3K15 KMT2A 1298/4885MEN1 2694/4885RAB9A 2089/4885
US-20060122249-A1 Condensed heterocyclic pyrazole derivatives as kinase inhibitors CDK2, MAP3K19, MAP3K15 KMT2A 1298/4885MEN1 2694/4885RAB9A 2089/4885

“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.