SCHEMBL21472789

SCHEMBL21472789

CSCC(=O)NCCCC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
SIGMAR1 Q99720 1/20 0.37
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CASP2 P42575 1/20 0.33
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NAAA Q02083 1/20 0.32
MAPK1 P28482 2/20 0.31
PKM P14618 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HIF1A Q16665 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 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
SCHEMBL10104241 0.83 KMT2A (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2CASP2
SCHEMBL13374399 0.78 CASP2 (0.45) KMT2AMEN1SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL13374400 0.78 MEN1 (0.43) KMT2AMEN1SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL19220438 0.78 MEN1 (0.43) KMT2AMEN1SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL19069757 0.78 CASP2 (0.50) KMT2AMEN1CASP2NAAAHPGD
SCHEMBL7750774 0.78 MEN1 (0.67) KMT2AMEN1SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL13374398 0.78 TSHR (0.48) KMT2AMEN1SIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL21391510 0.77 TSHR (0.41) KMT2AMEN1ALDH1A1TSHRHTT
SCHEMBL21081551 0.76 FAAH (0.47) KMT2AMEN1ALDH1A1CASP2TSHR
SCHEMBL5204935 0.76 MEN1 (0.41) KMT2AMEN1SIGMAR1ALDH1A1SMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230130155-A1 MRNAS ENCODING METABOLIC REPROGRAMMING POLYPEPTIDES AND USES THEREOF ARES CAPITAL CORPORATION, AS AGENT 2023-04-27 US disclosed
US-20230027864-A1 COMPOSITIONS AND METHODS FOR DELIVERY OF AGENTS TO IMMUNE CELLS MODERNATX, INC. 2023-01-26 US disclosed
US-20220409536-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS ARES CAPITAL CORPORATION, AS AGENT 2022-12-29 US disclosed
US-20210154148-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS ARES CAPITAL CORPORATION, AS AGENT 2021-05-27 US disclosed
US-10857105-B2 Compounds and compositions for intracellular delivery of therapeutic agents MordernaTX, Inc. (US) 2020-12-08 US disclosed
US-20190314292-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS ARES CAPITAL CORPORATION, AS AGENT 2019-10-17 US disclosed
US-20190314291-A1 COMPOSITIONS AND METHODS FOR DELIVERY OF AGENTS TO IMMUNE CELLS MODERNATX, INC. 2019-10-17 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 (7 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-20210154148-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS LNPK, PLTP, PLIN3 KMT2A 4490/4885MEN1 3647/4885SIGMAR1 1906/4885
US-10857105-B2 Compounds and compositions for intracellular delivery of therapeutic agents LNPK, PLTP, PLIN3 KMT2A 4490/4885MEN1 3647/4885SIGMAR1 1906/4885
US-20190314292-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS LNPK, PLTP, PLIN3 KMT2A 4490/4885MEN1 3647/4885SIGMAR1 1906/4885
US-20230027864-A1 COMPOSITIONS AND METHODS FOR DELIVERY OF AGENTS TO IMMUNE CELLS LCP2, CD14, MYD88 KMT2A 3501/4885MEN1 3810/4885SIGMAR1 3642/4885
US-20220409536-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS LNPK, PLTP, PLIN3 KMT2A 4490/4885MEN1 3647/4885SIGMAR1 1906/4885
US-20230130155-A1 MRNAS ENCODING METABOLIC REPROGRAMMING POLYPEPTIDES AND USES THEREOF HMOX1, CD209, HMOX2 KMT2A 926/4885MEN1 4470/4885SIGMAR1 4427/4885
US-20190314291-A1 COMPOSITIONS AND METHODS FOR DELIVERY OF AGENTS TO IMMUNE CELLS LCP2, CD14, MYD88 KMT2A 3501/4885MEN1 3810/4885SIGMAR1 3642/4885

“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.