SCHEMBL23768802

SCHEMBL23768802

O=C(Nc1ccc2c(c1)OCCO2)Nc1ccc2c(c1)N(Cc1ccccc1)C(=O)CS2

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.65
TSHR P16473 1/20 0.54
ALDH1A1 P00352 2/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
MAPT P10636 7/20 0.50
POLB P06746 3/20 0.50
TP53 P04637 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
LMNA P02545 2/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HTT P42858 2/20 0.48
OPRM1 P35372 1/20 0.48
OPRD1 P41143 1/20 0.48
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47

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
SCHEMBL30343013 1.00 ALOX15 (0.65) ALOX15TSHRALDH1A1CYP2C9CYP2C19
SCHEMBL23768800 0.88 MAPT (0.58) ALOX15TSHRALDH1A1CYP2C9CYP2C19
SCHEMBL29979892 0.87 ALOX15 (0.50) ALOX15TSHRALDH1A1CYP2C9CYP2C19
SCHEMBL25138403 0.87 ALOX15 (0.50) ALOX15TSHRALDH1A1CYP2C9CYP2C19
SCHEMBL23768798 0.84 TSHR (0.60) TSHRALDH1A1CYP2C9CYP2C19MAPT
SCHEMBL29979355 0.83 MAPT (0.53) ALOX15TSHRALDH1A1CYP2C9CYP2C19
SCHEMBL23769074 0.83 MAPT (0.53) ALOX15TSHRALDH1A1CYP2C9CYP2C19
SCHEMBL23768995 0.82 ALDH1A1 (0.56) ALOX15ALDH1A1CYP2C9CYP2C19MAPT
SCHEMBL23769071 0.82 MAPT (0.52) ALOX15TSHRALDH1A1CYP2C9CYP2C19
SCHEMBL29978616 0.82 ALDH1A1 (0.56) ALOX15ALDH1A1CYP2C9CYP2C19MAPT

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-20230124361-A1 SMALL MOLECULE STING ANTAGONISTS CURADEV PHARMA PVT. LTD. (IN) 2023-04-20 US disclosed
WO-2021161230-A1 SMALL MOLECULE STING ANTAGONISTS CURADEV PHARMA PVT. LTD. (IN) 2021-08-19 WO 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-20230124361-A1 SMALL MOLECULE STING ANTAGONISTS STING1, CGAS, MAVS ALOX15 366/4885TSHR 1353/4885ALDH1A1 3672/4885

“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.