SCHEMBL2317428

SCHEMBL2317428

CNC(=O)Cc1cccc(-c2cc3c4c(cnc3n2S(=O)(=O)c2ccc(C)cc2)cnn4C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.36
CACNA1H O95180 1/20 0.35
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
IKBKB O14920 3/20 0.34
CHUK O15111 2/20 0.34
NAMPT P43490 2/20 0.34
CFD P00746 1/20 0.34
MET P08581 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
NTRK1 P04629 2/20 0.32
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32
CTSL P07711 1/20 0.32
PTK2 Q05397 1/20 0.32

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
SCHEMBL2319064 0.91 PTGDR2 (0.44) PTGDR2NAMPTCFDPSEN1PSEN2
SCHEMBL2314989 0.89 PTGDR2 (0.33) PTGDR2CACNA1HEGFRERBB2IKBKB
SCHEMBL2315602 0.87 ALDH1A1 (0.38) NAMPTKDM4EMAPTLMNA
SCHEMBL2315466 0.87 IKBKB (0.41) PTGDR2IKBKBCHUKNAMPTPSEN1
SCHEMBL2318263 0.87 KDM5B (0.41)
SCHEMBL2314706 0.86 POLB (0.46) KDM4E
SCHEMBL12390205 0.84 BRD4 (0.38) PTGDR2NAMPTPSEN1PSEN2APH1B
SCHEMBL2316160 0.83 SYK (0.36) PTGDR2EGFRMAPT
SCHEMBL2318264 0.83 ACLY (0.40) PTGDR2IKBKBCHUKNAMPTMAPT
SCHEMBL4357924 0.82 ACVR1 (0.38) PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785639-B2 Substituted dihydropyrazolo[3,4-D]pyrrolo[2,3-B]pyridines and methods of use thereof ABBVIE INC. (US) 2014-07-22 US disclosed
US-20110190489-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2011-08-04 US 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-20110190489-A1 Novel Tricyclic Compounds CCNI, IL2, IL4I1 PTGDR2 237/4885CACNA1H 2083/4885EGFR 1991/4885

“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.