SCHEMBL19345285

SCHEMBL19345285

N#Cc1ccc(-c2ccc(N3c4ccccc4Nc4ccccc43)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PGR P06401 5/20 0.40
POLB P06746 2/20 0.40
ELANE P08246 1/20 0.40
MMP3 P08254 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HRH3 Q9Y5N1 2/20 0.37
CHEK1 O14757 1/20 0.37
CYP11B2 P19099 1/20 0.37
TSHR P16473 1/20 0.36
KIF11 P52732 2/20 0.36
FAAH O00519 1/20 0.36
MGLL Q99685 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
XBP1 P17861 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL19344946 0.95 POLB (0.42) PGRPOLBELANEL3MBTL1KDM4E
SCHEMBL19345026 0.89 CHEK1 (0.40) PGRPOLBKDM4EALDH1A1CHEK1
SCHEMBL19344937 0.83 STS (0.42) PGRKDM4EALDH1A1CHEK1CYP11B2
SCHEMBL19344999 0.83 CHEK1 (0.39) PGRKDM4EALDH1A1CHEK1
SCHEMBL29405445 0.83 FAAH (0.47) ALDH1A1TSHRFAAHMGLL
SCHEMBL15470446 0.83 FAAH (0.47) ALDH1A1TSHRFAAHMGLL
SCHEMBL19344963 0.81 PGR (0.40) PGRPOLBELANEMMP3CYP11B2
SCHEMBL17883188 0.80 TSHR (0.50) PGRPOLBELANEKDM4EALDH1A1
SCHEMBL31324965 0.80 TSHR (0.50) PGRPOLBELANEKDM4EALDH1A1
SCHEMBL19345080 0.80 KDM4E (0.40) POLBL3MBTL1KDM4EALDH1A1CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170263871-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2017-09-14 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-20170263871-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE OR10J3, RPS10, OR51E2 PGR 1448/4885POLB 3436/4885ELANE 487/4885

“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.