SCHEMBL10239802

SCHEMBL10239802

COc1ccn2c(-c3cncc(Cl)n3)cnc2c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 7/20 0.50
KIT P10721 5/20 0.45
KDR P35968 9/20 0.43
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
CSF1R P07333 2/20 0.39
IGF1R P08069 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
SCHEMBL22918757 0.81 KIT (0.56) FLT3KITKDRPRMT5WDR77
SCHEMBL376746 0.81 IRAK4 (0.49) FLT3KDRPRMT5WDR77IGF1R
SCHEMBL376136 0.80 CSNK2A1 (0.39) FLT3KDR
SCHEMBL29868607 0.76 KIT (0.52) FLT3KITKDRPRMT5WDR77
SCHEMBL376287 0.75 PKM (0.54) FLT3
SCHEMBL24975663 0.74 FLT3 (0.62) FLT3KITKDRCSF1RIGF1R
SCHEMBL376585 0.74 FLT3 (0.68) FLT3KDR
SCHEMBL376280 0.74 CDK2 (0.38) KDRPRMT5WDR77IGF1R
SCHEMBL22918943 0.73 KIT (0.56) FLT3KITKDRPRMT5WDR77
SCHEMBL10239115 0.73 FLT3 (0.51) FLT3KITKDRCSF1RIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328890-B1 6 SUBSTITUTED 2-HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER (US) 2012-01-25 EP disclosed
US-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER INC (US) 2011-06-16 US disclosed
US-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER INC (US) 2011-06-16 US disclosed
WO-2010016005-A1 6 SUBSTITUTED 2-HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS PFIZER INC. (US) 2010-02-11 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-20110144084-A1 6 SUBSTITUTED 2- HETEROCYCLYLAMINO PYRAZINE COMPOUNDS AS CHK-1 INHIBITORS CHKA, CSNK1A1, CHKB FLT3 496/4885KIT 324/4885KDR 821/4885

“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.