SCHEMBL20135544

SCHEMBL20135544

Cc1cccc2nc(C3CCNCC3)oc12

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.46
CYP1A2 P05177 2/20 0.41
HSD17B10 Q99714 1/20 0.41
USP2 O75604 1/20 0.40
MPO P05164 1/20 0.40
HTR1A P08908 2/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
NR1H4 Q96RI1 1/20 0.36
CLK4 Q9HAZ1 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
SCHEMBL14266197 0.85 RAB9A (0.46) USP2MEN1KMT2ALMNAPOLB
SCHEMBL23411785 0.82 MPO (0.46) MPOHTR1ASLC6A2SLC6A4MEN1
SCHEMBL7965987 0.79 HTR2C (0.49) HTR2CCYP1A2HSD17B10MPOHTR1A
SCHEMBL7966615 0.79 LMNA (0.46) HTR2CMPOHTR1ASLC6A2SLC6A4
SCHEMBL204714 0.77 PARP1 (0.51)
SCHEMBL7966015 0.77 HTR2C (0.46) HTR2CUSP2MPOHTR1ASLC6A2
SCHEMBL373400 0.75 MPO (0.54) USP2MPOMEN1KMT2ALMNA
SCHEMBL20135667 0.73 MPO (0.42) HTR2CMPOMEN1KMT2AGABRA1
SCHEMBL29688843 0.73 MPO (0.42) HTR2CMPOMEN1KMT2AGABRA1
SCHEMBL2708939 0.71 MPO (0.59) HTR2CHSD17B10MPOPOLBGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107922347-B Novel imide derivatives and their use as pharmaceuticals 田边三菱制药株式会社 2022-06-28 CN disclosed
US-10407408-B2 Imide derivatives and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-09-10 US disclosed
US-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-03-14 US disclosed
EP-3321256-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 EP disclosed
CN-107922347-A New imide derivative and its purposes as medicine 田边三菱制药株式会社 2018-04-17 CN 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 (2 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-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MMP9, MMP10, MMP1 HTR2C 3534/4885CYP1A2 491/4885HSD17B10 1345/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 HTR2C 3675/4885CYP1A2 409/4885HSD17B10 1748/4885

“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.