SCHEMBL4599651

SCHEMBL4599651

CNC(=O)C(c1ccccc1)C(Cl)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.50
LMNA P02545 3/20 0.45
KMT2A Q03164 2/20 0.44
CYP2D6 P10635 1/20 0.42
HDAC1 Q13547 7/20 0.41
HDAC3 O15379 5/20 0.41
HDAC8 Q9BY41 5/20 0.41
HDAC4 P56524 4/20 0.41
HDAC6 Q9UBN7 4/20 0.41
HDAC7 Q8WUI4 3/20 0.41
HDAC2 Q92769 3/20 0.41
HDAC10 Q969S8 3/20 0.41
HDAC11 Q96DB2 3/20 0.41
HDAC9 Q9UKV0 3/20 0.41
HDAC5 Q9UQL6 3/20 0.41
CTSD P07339 1/20 0.41
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL5053652 0.80 FFAR2 (0.68) FFAR2LMNAKMT2ACYP2D6HDAC1
SCHEMBL29054565 0.80 CYP2D6 (0.61) LMNAKMT2ACYP2D6CTSDSMN1; SMN2
SCHEMBL6342212 0.78 LMNA (0.46) FFAR2LMNAKMT2ACYP2D6HDAC1
SCHEMBL6162357 0.77 LMNA (0.51) LMNAKMT2AHDAC1HDAC3HDAC8
SCHEMBL9055207 0.77 LMNA (0.51) LMNAKMT2AHDAC1HDAC3HDAC8
SCHEMBL6039993 0.74 LMNA (0.53) FFAR2LMNAKMT2AHDAC1HDAC3
SCHEMBL6837072 0.74 KMT2A (0.50) FFAR2LMNAKMT2ACYP2D6CTSD
Dimethylamine SCHEMBL7053166 0.73 LMNA (0.43) LMNAKMT2ACYP2D6HDAC1HDAC3
SCHEMBL7391810 0.73 ALOX5 (0.47) LMNAKMT2ACYP2D6ALDH1A1
SCHEMBL8927802 0.72 EPHX1 (0.46) LMNACYP2D6HDAC1HDAC3HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1426356-B1 INTERMEDIATE COMPOUNDS FOR THE PREPARATION OF MIRTAZAPINE AND THE PRODUCTION METHODS THEREOF MEDICHEM SA (ES) 2008-04-16 EP claimed
US-7265223-B2 Intermediate compounds for the preparation of mirtazapine and production methods thereof MEDICHEM, S.A. (ES) 2007-09-04 US claimed
US-20040236107-A1 Intermediate compounds for the preparation of mirtazapine and the production methods thereof MEDICHEM, S.A. (ES) 2004-11-25 US claimed
EP-1426356-A1 INTERMEDIATE COMPOUNDS FOR THE PREPARATION OF MIRTAZAPINE AND THE PRODUCTION METHODS THEREOF Medichem S.A. (ES) 2004-06-09 EP claimed
EP-1426356-B1 INTERMEDIATE COMPOUNDS FOR THE PREPARATION OF MIRTAZAPINE AND THE PRODUCTION METHODS THEREOF MEDICHEM SA (ES) 2008-04-16 EP disclosed
US-7265223-B2 Intermediate compounds for the preparation of mirtazapine and production methods thereof MEDICHEM, S.A. (ES) 2007-09-04 US disclosed
US-20040236107-A1 Intermediate compounds for the preparation of mirtazapine and the production methods thereof MEDICHEM, S.A. (ES) 2004-11-25 US disclosed
EP-1426356-A1 INTERMEDIATE COMPOUNDS FOR THE PREPARATION OF MIRTAZAPINE AND THE PRODUCTION METHODS THEREOF Medichem S.A. (ES) 2004-06-09 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-20040236107-A1 Intermediate compounds for the preparation of mirtazapine and the production methods thereof IMPDH1, MRM1, IMPDH2 FFAR2 4071/4885LMNA 491/4885KMT2A 2004/4885

“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.