SCHEMBL22130647

SCHEMBL22130647

CC(=O)NCC1=Cc2c(c(-c3ccccc3)cn2S(C)(=O)=O)C(=O)C1=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ELAVL1 Q15717 5/20 0.54
▸ MTNR1A P48039 2/20 0.37
▸ MTNR1B P49286 1/20 0.37
▸ PDCD1 Q15116 4/20 0.34
▸ CD274 Q9NZQ7 4/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ RORC P51449 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33

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
SCHEMBL22130646 0.89 ELAVL1 (0.56) ELAVL1MTNR1AMTNR1BPDCD1CD274
SCHEMBL22130648 0.82 ELAVL1 (0.60) ELAVL1ALOX5PTGS2
SCHEMBL22130680 0.78 ELAVL1 (0.47) ELAVL1TDP1
SCHEMBL22130729 0.78 ELAVL1 (0.61) ELAVL1ALOX5PTGS2
SCHEMBL22130713 0.77 ELAVL1 (0.41) ELAVL1MTNR1AMTNR1BPDCD1CD274
SCHEMBL22130717 0.73 ELAVL1 (0.55) ELAVL1MTNR1AMTNR1BKMT2ARORC
SCHEMBL22130645 0.72 ELAVL1 (0.62) ELAVL1
SCHEMBL22130676 0.71 KDM4E (0.40) ELAVL1KDM4ERXFP1KMT2A
SCHEMBL19737481 0.71 ELAVL1 (1.00) ELAVL1ALOX5PTGS2
SCHEMBL22130712 0.68 ELAVL1 (0.55) ELAVL1ALOX5PTGS2

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-10689342-B2 Aza-tanshinone derivatives, process for their preparation and their use in therapy UNIVERSITA' DEGLI STUDI DI TRENTO (IT) 2020-06-23 — — 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-10689342-B2 Aza-tanshinone derivatives, process for their preparation and their use in therapy AZI2, TPMT, TYMS ELAVL1 2765/4885MTNR1A 1994/4885MTNR1B 1933/4885

“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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