SCHEMBL14684132

SCHEMBL14684132

CC(C)(CN)C(=O)NCCN

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PAOX Q6QHF9 2/20 0.34
POLB P06746 2/20 0.33
MAOB P27338 2/20 0.33
CACNA1H O95180 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CNR1 P21554 1/20 0.32

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
SCHEMBL16259522 0.84 KDM4C (0.42) ALDH1A1PAOXPOLBCACNA1HSMN1; SMN2
SCHEMBL15001319 0.84 CNR1 (0.44) ALDH1A1HSD17B10POLBCACNA1HSMN1; SMN2
SCHEMBL9499386 0.84 CNR1 (0.34) ALDH1A1CYP2C9HPGDALOX15CYP2C19
SCHEMBL10297996 0.84 RIPK1 (0.46) ALDH1A1CYP2C9HPGDALOX15CYP2C19
SCHEMBL422608 0.81 POLB (0.44) ALDH1A1CYP2C9HPGDALOX15CYP2C19
SCHEMBL11957576 0.81 ALDH1A1 (0.37) ALDH1A1CYP2C9HPGDALOX15CYP2C19
SCHEMBL15001317 0.81 PTGS1 (0.44) ALDH1A1PAOXPOLBSMN1; SMN2MEN1
SCHEMBL15001543 0.81 ECE1 (0.39) CYP1A2TSHRKMT2ABLMKDM4E
SCHEMBL20221181 0.81 ALDH1A1 (0.35) ALDH1A1POLBCACNA1HSMN1; SMN2CNR1
SCHEMBL16259681 0.81 PAOX (0.36) ALDH1A1PAOXPOLBCACNA1HSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023178299-A1 PRODRUGS OF GANAXOLONE MARINUS PHARMACEUTICALS, INC. (US) 2023-09-21 WO disclosed
EP-2496596-B1 THERAPEUTIC PEPTIDES LYTIX BIOPHARMA AS (NO) 2017-01-11 EP disclosed
US-8809280-B2 Therapeutic peptides LYTIX BIOPHARMA AS (NO) 2014-08-19 US disclosed
US-20130035296-A1 THERAPEUTIC PEPTIDES LYTIX BIOPHARMA AS (NO) 2013-02-07 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-20130035296-A1 THERAPEUTIC PEPTIDES VIP, LNPEP, ANPEP ALDH1A1 4783/4885CYP2C9 4869/4885HPGD 3389/4885

“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.