SCHEMBL12004693

SCHEMBL12004693

CC(Oc1ccc(F)cc1-c1nc2c(Cl)cccc2cc1CNc1ncnc2[nH]cnc12)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 10/20 0.38
JAK2 O60674 2/20 0.33
JAK3 P52333 1/20 0.33
EGFR P00533 3/20 0.33
ERBB2 P04626 1/20 0.33
ALOX15 P16050 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
CTSA P10619 1/20 0.33
TSHR P16473 2/20 0.32
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL4182182 0.88 PIK3CD (0.46) PIK3CDJAK2JAK3ALOX15CTSA
SCHEMBL4179285 0.86 PIK3CD (0.38) PIK3CDJAK2JAK3EGFRERBB2
SCHEMBL27781344 0.85 PIK3CD (0.37) PIK3CDJAK2JAK3EGFRERBB2
SCHEMBL4178542 0.84 PIK3CD (0.40) PIK3CDJAK2JAK3ALOX15LMNA
SCHEMBL4182144 0.83 MEN1 (0.38) PIK3CDJAK2JAK3ALOX15LMNA
SCHEMBL4182599 0.82 PIK3CD (0.38) PIK3CDJAK2JAK3ALOX15LMNA
SCHEMBL16270359 0.82 AURKA (0.37) PIK3CDJAK2JAK3ALOX15LMNA
SCHEMBL4174015 0.81 PIK3CD (0.35) PIK3CDJAK2JAK3EGFRALOX15
SCHEMBL16270350 0.80 PIK3CD (0.44) PIK3CDALOX15LMNAHTTTSHR
SCHEMBL12005113 0.80 CLK4 (0.36) PIK3CDEGFRERBB2LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180105532-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2018-04-19 US disclosed
EP-3045458-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen, Inc (US) 2016-07-20 EP disclosed
US-8901135-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-12-02 US disclosed
US-20120220586-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-08-30 US disclosed
CN-101715453-B Heterocyclic compounds and their uses AMGEN INC 2012-06-27 CN disclosed
CN-101715453-A Heterogeneous ring compound and application thereof AMGEN INC 2010-05-26 CN 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-20120220586-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 PIK3CD 16/4885JAK2 67/4885JAK3 206/4885
US-20180105532-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 PIK3CD 16/4885JAK2 67/4885JAK3 206/4885

“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.