SCHEMBL15434628

SCHEMBL15434628

CC(=O)NCc1ccccc1CC(C)C

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.49
SETDB1 Q15047 1/20 0.49
GABRA1 P14867 1/20 0.46
GABRB2 P47870 1/20 0.46
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
MTNR1B P49286 4/20 0.42
CYP2D6 P10635 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
NQO2 P16083 1/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL14204990 0.87 SETDB1 (0.59) MTNR1ASETDB1HPGDNPSR1MTNR1B
SCHEMBL9635048 0.86 ALDH1A1 (0.47) GABRA1GABRB2HPGDHTTCYP2D6
SCHEMBL10125651 0.83 HPGD (0.66) GABRA1GABRB2HPGDHTTNPC1
SCHEMBL13154935 0.81 HTT (0.46) GABRA1GABRB2HPGDHTTNPSR1
SCHEMBL14651452 0.81 SETDB1 (0.54) MTNR1ASETDB1HPGDHTTNPSR1
SCHEMBL29675775 0.79 SETDB1 (0.53) MTNR1ASETDB1HPGDNPSR1MTNR1B
SCHEMBL22803243 0.79 HPGD (0.48) GABRA1GABRB2HPGDHTTNPC1
Bicarbonate SCHEMBL27568192 0.78 GABRA1 (0.58) GABRA1GABRB2NPC1
SCHEMBL10781973 0.78 SETDB1 (0.51) MTNR1ASETDB1HPGDNPSR1MTNR1B
SCHEMBL17123628 0.78 SETDB1 (0.51) MTNR1ASETDB1HPGDNPSR1MTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634710-B2 Oligonucleotide compositions and methods thereof WAVE LIFE SCIENCES LTD. (SG) 2023-04-25 US disclosed
US-20220195429-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2022-06-23 US disclosed
US-20200299692-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2020-09-24 US disclosed
US-20200157545-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2020-05-21 US disclosed
WO-2017192679-A1 METHODS AND COMPOSITIONS OF BIOLOGICALLY ACTIVE AGENTS WAVE LIFE SCIENCES LTD. (SG) 2017-11-09 WO disclosed
WO-2014012081-A2 CHIRAL CONTROL ONTORII, INC. (US) 2014-01-16 WO 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 (4 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-20200299692-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF RBM17, HNRNPA2B1, HNRNPA1 MTNR1A 2567/4885SETDB1 1463/4885GABRA1 4045/4885
US-20200157545-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF RNASE1, RNASEH1, RNASEL MTNR1A 2382/4885SETDB1 625/4885GABRA1 4794/4885
US-20220195429-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF RNGTT, NSUN2, POLRMT MTNR1A 2897/4885SETDB1 182/4885GABRA1 4596/4885
US-11634710-B2 Oligonucleotide compositions and methods thereof RBM17, HNRNPA2B1, HNRNPA1 MTNR1A 2567/4885SETDB1 1463/4885GABRA1 4045/4885

“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.