SCHEMBL21230498

SCHEMBL21230498

CCCCCCCCc1cncc(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 3/20 0.54
▸ CASP3 P42574 1/20 0.47
▸ SENP8 Q96LD8 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP6 Q9GZR1 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CHRNB2 P17787 1/20 0.45
▸ CHRNA4 P43681 1/20 0.45
▸ GGPS1 O95749 2/20 0.45
▸ GPR84 Q9NQS5 1/20 0.43
▸ FUT7 Q11130 1/20 0.43
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40

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
SCHEMBL19236843 1.00 PTGS2 (0.54) PTGS2CASP3SENP8SENP7SENP6
SCHEMBL20467133 1.00 PTGS2 (0.54) PTGS2CASP3SENP8SENP7SENP6
SCHEMBL21711162 0.98 PTGS2 (0.56) PTGS2CASP3SENP8SENP7SENP6
SCHEMBL17827870 0.93 CHRNB2 (0.50) PTGS2CASP3SENP8SENP7SENP6
SCHEMBL14109605 0.85 CHRNB2 (0.48) PTGS2CHRNB2CHRNA4CYP11B1CYP11B2
SCHEMBL27563659 0.83 TDP1 (0.57) PTGS2TDP1L3MBTL1GPR84
SCHEMBL27733869 0.81 TDP1 (0.59) PTGS2TDP1L3MBTL1GPR84
SCHEMBL31185907 0.80 PTGS2 (0.73) PTGS2GPR84FUT7CA1CA2
SCHEMBL31185832 0.80 PTGS2 (0.73) PTGS2GPR84FUT7CA1CA2
SCHEMBL18586439 0.80 PTGS2 (0.73) PTGS2GPR84FUT7CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10669568-B2 Substituted imidazo[1,2-a]pyrazines as luciferase substrates PROMEGA CORPORATION (US) 2020-06-02 — — US disclosed
US-20190241932-A1 COELENTERAZINE ANALOGUES PROMEGA CORPORATION 2019-08-08 — — 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 (2 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-20190241932-A1 COELENTERAZINE ANALOGUES GLB1, SI, TCF7L2 PTGS2 2136/4885CASP3 713/4885SENP8 2530/4885
US-10669568-B2 Substituted imidazo[1,2-a]pyrazines as luciferase substrates AADAC, PGLS, GLB1 PTGS2 653/4885CASP3 2851/4885SENP8 1856/4885

“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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