SCHEMBL27099048

SCHEMBL27099048

CCCCCNC(=O)CCc1c[nH]c2ccccc12

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.80
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
MAPT P10636 2/20 0.66
GFER P55789 1/20 0.65
ALDH1A1 P00352 1/20 0.62
GAA P10253 1/20 0.62
AANAT Q16613 1/20 0.60
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
PKM P14618 1/20 0.59
TSHR P16473 1/20 0.59
CYP2C19 P33261 1/20 0.59
BLM P54132 1/20 0.59
TRPV1 Q8NER1 2/20 0.58
HPGD P15428 1/20 0.58
POLB P06746 1/20 0.58

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
SCHEMBL27099051 0.99 MTNR1A (0.82) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL27099044 0.91 MTNR1A (0.77) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL29926356 0.90 MTNR1A (0.98) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL6646410 0.90 MTNR1A (0.88) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL1727281 0.89 MTNR1A (1.00) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL3806536 0.89 MTNR1A (1.00) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL1066221 0.89 MTNR1A (1.00) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL1724741 0.89 MTNR1A (1.00) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL22411433 0.89 MTNR1A (1.00) MTNR1AMEN1KMT2AMAPTGFER
SCHEMBL1725354 0.89 MTNR1A (1.00) MTNR1AMEN1KMT2AMAPTGFER

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-11912687-B2 3,4,5-trisubstituted-1,2,4-triazoles and 3,4,5-trisubstituted-3-thio-1,2,4-triazoles and uses thereof Board of Trustees of the Southern Illinois University (US) 2024-02-27 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-11912687-B2 3,4,5-trisubstituted-1,2,4-triazoles and 3,4,5-trisubstituted-3-thio-1,2,4-triazoles and uses thereof SSTR4, SSTR5, SSTR3 MTNR1A 178/4885MEN1 1253/4885KMT2A 4067/4885

“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.