SCHEMBL5656484

SCHEMBL5656484

CCCn1ccnc1C(O)c1ccc(N)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
L3MBTL1 Q9Y468 1/20 0.50
LMNA P02545 2/20 0.49
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
KDM4E B2RXH2 1/20 0.47
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 1/20 0.40
TLR8 Q9NR97 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
CYP19A1 P11511 1/20 0.38

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
SCHEMBL27678492 0.92 MAPT (0.54) MAPTL3MBTL1LMNACYP1A2CYP2D6
SCHEMBL6651894 0.80 KDM4E (0.71) MAPTL3MBTL1LMNACYP1A2CYP2D6
SCHEMBL4899071 0.78 MAPT (0.54) MAPTL3MBTL1LMNACYP1A2CYP2D6
SCHEMBL4908281 0.75 MAPT (0.57) MAPTL3MBTL1LMNACYP1A2CYP2D6
SCHEMBL5654106 0.75 SMN1; SMN2 (0.49) MAPTL3MBTL1KMT2AALDH1A1TLR8
SCHEMBL4908674 0.73 MAPT (0.52) MAPTL3MBTL1LMNACYP1A2CYP2D6
Butyl Chloride SCHEMBL27485209 0.73 KDM4E (0.56) MAPTL3MBTL1LMNACYP1A2CYP2D6
SCHEMBL4910266 0.72 MAPT (0.48) MAPTL3MBTL1LMNACYP1A2CYP2D6
SCHEMBL4912548 0.72 MAPT (0.48) MAPTL3MBTL1LMNACYP1A2CYP2D6
SCHEMBL11669834 0.71 LMNA (0.57) MAPTL3MBTL1LMNACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262185-B2 Benzazepine derivative, process for producing the same, and use TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2007-08-28 US disclosed
US-20040235822-A1 Benzazepine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-11-25 US disclosed
EP-1422228-A1 BENZAZEPINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Chemical Industries, Ltd. (JP) 2004-05-26 EP 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-20040235822-A1 Benzazepine derivative, process for producing the same, and use CYP1B1, CYP1A1, CYP2E1 MAPT 3095/4885L3MBTL1 2184/4885LMNA 753/4885

“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.