SCHEMBL27114960

SCHEMBL27114960

CC(C)NCC(=O)N1CCN(c2ccc(CNC(=N)N)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.44
▸ GAA P10253 6/20 0.44
▸ MAPT P10636 5/20 0.44
▸ ALOX15 P16050 5/20 0.44
▸ ALOX12 P18054 5/20 0.44
▸ KDM4E B2RXH2 4/20 0.44
▸ LMNA P02545 4/20 0.44
▸ HTT P42858 3/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ TSHR P16473 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PPID Q08752 1/20 0.44
▸ TP53 P04637 1/20 0.42
▸ GFER P55789 4/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 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
SCHEMBL27116713 0.87 ITGB3 (0.43) SMN1; SMN2MAPTKDM4ELMNAHTT
SCHEMBL27114914 0.85 MAPT (0.51) SMN1; SMN2GAAMAPTKDM4EMAPK1
SCHEMBL27116715 0.84 SMN1; SMN2 (0.45) SMN1; SMN2GAAMAPTALOX15ALOX12
SCHEMBL27114134 0.83 TP53 (0.47) SMN1; SMN2GAAMAPTALOX15ALOX12
SCHEMBL27119572 0.78 KMT2A (0.44) SMN1; SMN2GAAMAPTALOX15KDM4E
SCHEMBL27116714 0.73 F2 (0.41) GAAMAPTALOX15ALOX12KDM4E
SCHEMBL27114555 0.73 ALDH1A1 (0.42) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL27114132 0.73 F2 (0.41) SMN1; SMN2GAAMAPTLMNAHTT
SCHEMBL16181284 0.72 PARP1 (0.39) TSHRCYP2C19CA1CA2
SCHEMBL24891910 0.72 MAPT (0.53) SMN1; SMN2MAPTALOX15KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066135-A1 DRUG CONJUGATES AND USES THEREOF SUPERTRANS MEDICAL LTD (IL) 2024-02-29 — — 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-20240066135-A1 DRUG CONJUGATES AND USES THEREOF SLC7A1, ABCB11, SLC1A5 SMN1; SMN2 4664/4885GAA 350/4885MAPT 2991/4885

“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.

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