SCHEMBL18237464

SCHEMBL18237464

CC(C)C(=O)NCCC[Si](C)(C)O[Si](C)(C)CNc1ncccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 8/20 0.41
MTNR1B P49286 8/20 0.41
KMT2A Q03164 2/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
BRD4 O60885 1/20 0.33
PDPK1 O15530 1/20 0.33
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RECQL P46063 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
SCHEMBL18237347 0.82 CYP2C9 (0.46) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9
SCHEMBL18227216 0.81 KMT2A (0.45) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9
SCHEMBL18237352 0.79 KMT2A (0.40) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9
SCHEMBL20964586 0.76 ALDH1A1 (0.55) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9
SCHEMBL18227316 0.76 ALDH1A1 (0.50) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL18238491 0.76 CYP2C19 (0.39) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9
SCHEMBL18237605 0.76 CYP2C19 (0.39) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9
SCHEMBL18227240 0.74 KMT2A (0.40) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9
SCHEMBL13171211 0.66 KMT2A (0.42) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9
SCHEMBL18237463 0.65 KMT2A (0.47) MTNR1AMTNR1BKMT2ACYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230000993-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO INC (US) 2023-01-05 US disclosed
US-20230000993-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO INC (US) 2023-01-05 US disclosed
US-11291731-B2 Silicon based drug conjugates and methods of using same BLINKBIO, INC. (US) 2022-04-05 US disclosed
US-20190290771-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2019-09-26 US disclosed
US-20190290771-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2019-09-26 US disclosed
US-9931407-B2 Silicon based drug conjugates and methods of using same BLINKBIO, INC. (US) 2018-04-03 US disclosed
US-9931407-B2 Silicon based drug conjugates and methods of using same BLINKBIO, INC. (US) 2018-04-03 US disclosed
US-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 US disclosed
US-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 US disclosed
WO-2016183359-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. (US) 2016-11-17 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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT MTNR1A 3961/4885MTNR1B 4306/4885KMT2A 1005/4885
US-11291731-B2 Silicon based drug conjugates and methods of using same CD44, MSN, AS3MT MTNR1A 3961/4885MTNR1B 4306/4885KMT2A 1005/4885
US-20190290771-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT MTNR1A 3961/4885MTNR1B 4306/4885KMT2A 1005/4885
US-20230000993-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT MTNR1A 3961/4885MTNR1B 4306/4885KMT2A 1005/4885

“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.