SCHEMBL5656670

SCHEMBL5656670

CCCn1ccnc1CN(C)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.50
CRHBP P24387 2/20 0.49
CRHR2 Q13324 2/20 0.49
NOS1 P29475 1/20 0.43
KMT2A Q03164 5/20 0.40
MEN1 O00255 3/20 0.40
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
CYP19A1 P11511 3/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ATM Q13315 1/20 0.37
TLR9 Q9NR96 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL5657335 0.81 MAPT (0.49) MAPTCRHBPCRHR2KMT2AMEN1
SCHEMBL5657907 0.80 TLR8 (0.39) MAPTKMT2AALDH1A1POLBRAB9A
SCHEMBL5659388 0.80 CRHBP (0.49) MAPTCRHBPCRHR2NOS1KMT2A
SCHEMBL7905618 0.76 KMT2A (0.47) MAPTNOS1KMT2AMEN1ALDH1A1
SCHEMBL5655700 0.73 ALDH1A1 (0.44) MAPTNOS1KMT2AMEN1ALDH1A1
SCHEMBL2393251 0.73 CRHBP (0.68) MAPTCRHBPCRHR2KMT2AALDH1A1
SCHEMBL3182549 0.72 HTT (0.54) MAPTNOS1KMT2AMEN1ALDH1A1
SCHEMBL1646112 0.72 POLB (0.50) MAPTNOS1KMT2AMEN1ALDH1A1
SCHEMBL5655336 0.72 NOS1 (0.50) MAPTNOS1KMT2AMEN1ALDH1A1
Nitric Acid SCHEMBL16700757 0.71 ALPG (0.42) MAPTNOS1KMT2AALDH1A1POLB

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 3095/4885CRHBP 4575/4885CRHR2 1762/4885

“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.