SCHEMBL21366052

SCHEMBL21366052

COC(=O)c1nsc(C(=O)Cl)n1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.39
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 6/20 0.33
KDM4E B2RXH2 3/20 0.32
TRPM8 Q7Z2W7 1/20 0.31
F2 P00734 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL21366056 0.83 NPSR1 (0.40) NPSR1KMT2AMAPTTSHRHSD17B10
SCHEMBL7915881 0.81 NPSR1 (0.41) NPSR1KMT2AMAPTTSHRHSD17B10
SCHEMBL20320394 0.75 NPSR1 (0.43) NPSR1KMT2AMAPTTSHRHSD17B10
SCHEMBL25605109 0.75 NPSR1 (0.43) NPSR1KMT2AMAPTTSHRHSD17B10
SCHEMBL10838902 0.73 NPSR1 (0.41) NPSR1KMT2AMAPTTSHRHSD17B10
SCHEMBL5391630 0.73 NPSR1 (0.41) NPSR1KMT2AMAPTTSHRHSD17B10
SCHEMBL21366414 0.70 NPSR1 (0.39) NPSR1KMT2AMAPTTSHRHSD17B10
SCHEMBL8572004 0.68 NPSR1 (0.33) NPSR1ALDH1A1KDM4E
SCHEMBL18572717 0.67 NPSR1 (0.60) NPSR1KMT2AMAPTTSHRHSD17B10
SCHEMBL7982893 0.67 NPSR1 (0.43) NPSR1KMT2AMAPTTSHRHSD17B10

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
EP-3564239-B9 ARYL HYDROCARBON RECEPTOR MODULATOR ARIAGEN INC (US) 2023-04-19 EP disclosed
US-11547698-B2 Aryl hydrocarbon receptor modulators ARIAGEN, INC. (US) 2023-01-10 US disclosed
EP-3564239-A1 ARYL HYDROCARBON RECEPTOR MODULATOR Shenzhen Immunova Pharmaceutical Co., Ltd. (CN) 2019-11-06 EP disclosed
US-20190330201-A1 ARYL HYDROCARBON RECEPTOR MODULATORS AHR PHARMACEUTICALS, INC. 2019-10-31 US disclosed
US-20190307731-A1 ARYL HYDROCARBON RECEPTOR MODULATOR ARIAGEN, INC. (US) 2019-10-10 US disclosed
US-20190284149-A1 ARYL HYDROCARBON RECEPTOR MODULATOR ARIAGEN, INC. (US) 2019-09-19 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 (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-20190307731-A1 ARYL HYDROCARBON RECEPTOR MODULATOR AHR, ARNT, NR1H4 NPSR1 157/4885KMT2A 1490/4885MAPT 4875/4885
US-11547698-B2 Aryl hydrocarbon receptor modulators AHR, ARNT, CNR1 NPSR1 104/4885KMT2A 1471/4885MAPT 4838/4885
US-20190284149-A1 ARYL HYDROCARBON RECEPTOR MODULATOR AHR, ARNT, NR1H4 NPSR1 178/4885KMT2A 1445/4885MAPT 4863/4885
US-20190330201-A1 ARYL HYDROCARBON RECEPTOR MODULATORS AHR, ARNT, CNR1 NPSR1 104/4885KMT2A 1471/4885MAPT 4838/4885

“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.