SCHEMBL16405702

SCHEMBL16405702

Cc1ccc(-c2ccc(N)cc2)c(-c2ccncc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP46A1 Q9Y6A2 1/20 0.46
MAPK14 Q16539 3/20 0.45
GCGR P47871 2/20 0.43
NTRK1 P04629 1/20 0.42
MAPT P10636 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MAOB P27338 1/20 0.42
RECQL P46063 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CYP17A1 P05093 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42

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
SCHEMBL16405699 0.89 IMPDH2 (0.45) CYP46A1MAPK14GCGRNTRK1MAPT
SCHEMBL16405698 0.89 CYP46A1 (0.46) CYP46A1MAPK14NTRK1MAPTMEN1
SCHEMBL25871395 0.89 CYP46A1 (0.54) CYP46A1MAPK14GCGRMAPTMEN1
SCHEMBL16405692 0.85 IMPDH2 (0.50) MAPK14GCGRNTRK1MAPTMEN1
SCHEMBL3422005 0.85 CYP46A1 (0.54) CYP46A1MAPK14GCGRMAPTMEN1
SCHEMBL16405700 0.82 CYP2A6 (0.46) MAPTMEN1NPC1RAB9AALDH1A1
SCHEMBL4477118 0.79 CYP46A1 (0.50) CYP46A1MAPK14GCGRMAPTMEN1
SCHEMBL29437718 0.79 ACHE (0.56) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL260855 0.79 ACHE (0.56) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL16405694 0.77 IMPDH2 (0.53) MAPK14GCGRNTRK1MAPTMEN1

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-9353222-B2 Composition, polymer film, and display device SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-05-31 US disclosed
US-20150025200-A1 COMPOSITION, POLYMER FILM, AND DISPLAY DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-01-22 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-20150025200-A1 COMPOSITION, POLYMER FILM, AND DISPLAY DEVICE DDT, DTD1, DRD1 CYP46A1 3888/4885MAPK14 2346/4885GCGR 3689/4885

“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.