SCHEMBL890545

SCHEMBL890545

CSc1ccccc1-c1c(C(C)N2C(=O)c3ccccc3C2=O)nc2ccccn2c1=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.44
HTR6 P50406 2/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PIK3CD O00329 9/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
THRB P10828 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CYP19A1 P11511 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL890481 0.83 PIK3CD (0.54) KDM4EHTR6PIK3CDHSP90AA1HSP90AB1
SCHEMBL890589 0.80 HSP90AA1 (0.42) KDM4EHTR6HSP90AA1HSP90AB1ALDH1A1
SCHEMBL10119947 0.70 PIK3CD (0.43) KDM4EPIK3CDHSP90AA1HSP90AB1ALDH1A1
SCHEMBL10120340 0.68 PIK3CD (0.36) KDM4EMEN1KMT2APIK3CDHSP90AA1
SCHEMBL890536 0.68 PIK3CD (0.59) KDM4EHTR6PIK3CDHSP90AA1HSP90AB1
SCHEMBL890516 0.68 PIK3CD (0.54) KMT2APIK3CDGAASMN1; SMN2RAB9A
SCHEMBL890522 0.67 PIK3CD (0.56) PIK3CD
SCHEMBL15303258 0.66 MAPT (0.34) KDM4EKMT2AALDH1A1SMN1; SMN2POLB
SCHEMBL17718331 0.66 PIK3CD (0.46) PIK3CDALDH1A1POLBNPSR1CYP2C9
SCHEMBL890593 0.65 PIK3CD (0.52) KMT2APIK3CDGAASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754089-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-06-17 US disclosed
US-8754089-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-06-17 US disclosed
US-8754089-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-06-17 US disclosed
EP-2445898-A2 4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE DERIVATIVES AS PI3K INHIBITORS Amgen, Inc (US) 2012-05-02 EP disclosed
US-20120083502-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-05 US disclosed
US-20120083502-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-05 US disclosed
US-20120083502-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-05 US disclosed
WO-2010151735-A2 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-29 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-20120083502-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 KDM4E 1436/4885HTR6 3107/4885MEN1 1146/4885

“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.