SCHEMBL7307499

SCHEMBL7307499

CC1=NCC2CNC(c3ccccc3F)c3cc(Cl)ccc3N12

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 2/20 0.42
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
CYP3A4 P08684 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
SLC22A1 O15245 1/20 0.34
ABCB11 O95342 1/20 0.34
DRD3 P35462 1/20 0.34
OPRK1 P41145 1/20 0.34
PDE4D Q08499 1/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD11B1 P28845 1/20 0.31

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
SCHEMBL30465833 1.00 PTAFR (0.42) PTAFRHTR2AHTR2CCYP3A4CYP1A2
SCHEMBL26192478 0.81 PTAFR (0.41) PTAFRHTR2AHTR2CCYP3A4CYP1A2
SCHEMBL25312604 0.74 CYP3A4 (0.35) PTAFRCYP3A4CYP1A2CYP2D6CYP2C19
SCHEMBL2969718 0.72 CYP3A4 (0.54) PTAFRHTR2ACYP3A4SLC22A1ABCB11
SCHEMBL11683129 0.71 HTR2C (0.46) PTAFRHTR2AHTR2CCYP3A4CYP1A2
SCHEMBL7317807 0.70 PTAFR (0.54) PTAFRHTR2AHTR2CCYP3A4CYP1A2
SCHEMBL8532472 0.69 CYP3A4 (0.40) CYP3A4SLC22A1ABCB11DRD3OPRK1
SCHEMBL11680638 0.67 HTR2A (0.42) PTAFRHTR2AHTR2CCYP3A4CYP1A2
SCHEMBL7315680 0.65 PTAFR (0.47) PTAFRHTR2AHTR2CCYP3A4CYP1A2
SCHEMBL7305688 0.65 OPRK1 (0.55) HTR2COPRK1PDE4D

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230210865-A1 MIDAZOLAM PREMIX FORMULATIONS AND USES THEREOF BAXTER INT (US) 2023-07-06 US disclosed
US-20230210865-A1 MIDAZOLAM PREMIX FORMULATIONS AND USES THEREOF BAXTER INT (US) 2023-07-06 US disclosed
WO-2023129902-A1 MIDAZOLAM PREMIX FORMULATIONS AND USES THEREOF BAXTER INTERNATIONAL INC. (US) 2023-07-06 WO disclosed
WO-2023129902-A1 MIDAZOLAM PREMIX FORMULATIONS AND USES THEREOF BAXTER INTERNATIONAL INC. (US) 2023-07-06 WO disclosed
US-4440685-A MUSCLE RELAXANTS, SEDATIVES, ANTICONVULSANTS HOFFMANN-LA ROCHE INC. (US) 1984-04-03 US disclosed
US-4425272-A ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1984-01-10 US disclosed
US-4401597-A INTERMEDIATES FOR ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVE AND ANXIOLYTICS HOFFMANN-LA ROCHE INC. (US) 1983-08-30 US disclosed
US-4390471-A INTERMEDIATES FOR IMIDOBENZODIAZEPINE AND ANALOGS HOFFMANN-LA ROCHE INC. (US) 1983-06-28 US disclosed
US-4377523-A Imidazodiazepines and processes therefor HOFFMANN-LA ROCHE INC. (US) 1983-03-22 US disclosed
US-4376074-A ANTICONVULSANTS, MUSCLE RELAXANTS AND SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-03-08 US disclosed
US-4368157-A ANTICONVULSANTS, MUSCLE RELAXANTS, TRANQUILIZERS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-01-11 US disclosed
US-4368159-A ANTICONVULSANTS, MUSCLE RELAXANTS, TRANQUILIZERS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-01-11 US disclosed
US-4368158-A ANTICONVULSANTS, MUSCLE RELAXANTS, TRANQUILIZERS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-01-11 US disclosed
US-4349477-A IMIPAZO/1,5-A//1,4/BENZO-, THIENO- OR PYRAZOLODIAZEPINES FROM 2-DIMORPHOLINOPHOSPHONATES OF BENZO-, THIENO- OR PYRAZOLODIAZEPINES HOFFMANN-LA ROCHE INC. (US) 1982-09-14 US disclosed
US-4349476-A IMIDAZO/1,5-A//1,4) BENZO-, THIENO-, OR PYRAZOLODIAZEPINES FROM DERIVATIVES OF BENZO-, THIENO- OR PYRAZOLODIAZEPINE HOFFMANN-LA ROCHE INC. (US) 1982-09-14 US disclosed
US-4349475-A IMIDAZO/1,5-A//1,4/BENZO-, THIENO-, OR PYRAZOLODIAZEPINES FROM DERIVATIVES OF BENZOTHIENO-OR PYRAZOLODIAZEPINES HOFFMANN-LA ROCHE INC. (US) 1982-09-14 US disclosed
US-4347365-A ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1982-08-31 US disclosed
US-4347364-A INTERMEDIATES THEREFOR HOFFMANN-LA ROCHE INC. (US) 1982-08-31 US disclosed
US-4307237-A ANTICONVULSANTS, SEDATIVES, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1981-12-22 US disclosed
US-4280957-A Imidazodiazepines and processes therefor HOFFMANN-LA ROCHE INC. (US) 1981-07-28 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-20230210865-A1 MIDAZOLAM PREMIX FORMULATIONS AND USES THEREOF SLC6A13, CYP3A5, CYP3A4 PTAFR 4722/4885HTR2A 291/4885HTR2C 141/4885

“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.