SCHEMBL2848707

SCHEMBL2848707

Clc1cncc(-n2cncn2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
HTR1A P08908 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 2/20 0.40
CYP2A6 P11509 1/20 0.38
CDK2 P24941 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.34
PIM1 P11309 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.30

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
SCHEMBL13354427 0.77 CYP2A6 (0.38) KDM4EALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL13086437 0.73 CYP2A6 (0.39) KDM4EALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL6664965 0.72 KDM4E (0.75) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL25584932 0.69 PDE4A (0.38) KDM4EALDH1A1CYP2A6
SCHEMBL558692 0.69 PIM1 (0.38) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL11090930 0.69 KDM4E (0.40) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL21764269 0.68 CYP2A6 (0.48) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL16505415 0.68 KDM4E (0.44) KDM4EALDH1A1CYP1A2CYP3A4HTR1A
SCHEMBL17203651 0.68 KDM4E (0.43) KDM4EALDH1A1MAPTCYP2A6CDK2
SCHEMBL1963980 0.68 KMT2A (0.49) KDM4EALDH1A1MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106458979-A Aminopyrazine derivatives as phosphatidylinositol 3-kinase inhibitors 诺华股份有限公司 2017-02-22 CN disclosed
EP-2152700-B1 CSF-1R INHIBITORS, COMPOSITIONS, AND METHODS OF USE NOVARTIS AG (CH) 2013-12-11 EP disclosed
US-8293769-B2 CSF-1R inhibitors, compositions, and methods of use NOVARTIS AG (CH) 2012-10-23 US disclosed
US-8293769-B2 CSF-1R inhibitors, compositions, and methods of use NOVARTIS AG (CH) 2012-10-23 US disclosed
US-8293769-B2 CSF-1R inhibitors, compositions, and methods of use NOVARTIS AG (CH) 2012-10-23 US disclosed
CN-101754965-A CSF-1R inhibitors, compositions, and methods of use NOVARTIS AG 2010-06-23 CN disclosed
US-20100130490-A1 CSF-1R INHIBITORS,COMPOSITIONS, AND METHODS OF USE NOVARTIS AG (CH) 2010-05-27 US disclosed
US-20100130490-A1 CSF-1R INHIBITORS,COMPOSITIONS, AND METHODS OF USE NOVARTIS AG (CH) 2010-05-27 US disclosed
US-20100130490-A1 CSF-1R INHIBITORS,COMPOSITIONS, AND METHODS OF USE NOVARTIS AG (CH) 2010-05-27 US disclosed
EP-2152700-A1 CSF-1R INHIBITORS, COMPOSITIONS, AND METHODS OF USE Novartis Ag (CH) 2010-02-17 EP disclosed
WO-2008144062-A1 CSF-1R INHIBITORS, COMPOSITIONS, AND METHODS OF USE NOVARTIS AG (CH) 2008-11-27 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-20100130490-A1 CSF-1R INHIBITORS,COMPOSITIONS, AND METHODS OF USE CSF1R, CSF3R, FLT3 KDM4E 1776/4885ALDH1A1 623/4885MEN1 1073/4885

“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.