SCHEMBL22130736

SCHEMBL22130736

Cc1nn(S(C)(=O)=O)c2c1C(=O)C(=O)C=C2

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELAVL1 Q15717 2/20 0.40
HIF1A Q16665 1/20 0.30
MEN1 O00255 1/20 0.30
TSHR P16473 1/20 0.30
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL22130638 0.76 MEN1 (0.30) MEN1TSHRKMT2A
SCHEMBL22130643 0.71
SCHEMBL22130701 0.67 ELAVL1 (0.38) ELAVL1
SCHEMBL22130658 0.67 ELAVL1 (0.59) ELAVL1
SCHEMBL17322918 0.57 ELANE (0.45) MEN1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL22130656 0.57 ELAVL1 (0.49) ELAVL1MEN1KMT2AALDH1A1HSD17B10
SCHEMBL21888965 0.53 MEN1 (0.37) MEN1TSHRKMT2A
SCHEMBL21888987 0.52 MEN1 (0.33) MEN1TSHRKMT2A
SCHEMBL22802479 0.52 ALDH1A1 (0.37) MEN1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL8733374 0.51 IDO1 (0.33) MEN1KMT2AALDH1A1HSD17B10

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 2765/4885HIF1A 513/4885MEN1 3554/4885

“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.