SCHEMBL5569137

SCHEMBL5569137

C=Cc1ccc(SC2CCOC2=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 7/20 0.41
MAPK1 P28482 3/20 0.41
POLB P06746 3/20 0.41
HSD17B10 Q99714 2/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP2C19 P33261 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
CYP1A2 P05177 2/20 0.39
HPGD P15428 2/20 0.39
TP53 P04637 1/20 0.39
PKM P14618 1/20 0.39
PPARG P37231 1/20 0.39
NCOA2 Q15596 1/20 0.39
CYP3A4 P08684 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 2/20 0.37
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL31708217 0.86 HSD17B10 (0.44) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL4491902 0.82 KMT2A (0.44) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL4501819 0.82 KMT2A (0.44) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL15746491 0.79 DDB1 (0.51) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL875841 0.79 MAPK1 (0.58) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL873535 0.79 DDB1 (0.51) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL877603 0.79 POLB (0.53) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL7981025 0.78 MAPK1 (0.56) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL872472 0.75 DDB1 (0.55) KMT2AALDH1A1MAPK1POLBHSD17B10
SCHEMBL14517050 0.75 ALDH1A1 (0.56) KMT2AALDH1A1MAPK1POLBHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7226906-B2 Cyclosporin analogs for the treatment of immunoregulatory disorders and respiratory diseases ARRAY BIOPHARMA, INC. (US) 2007-06-05 US disclosed
WO-2006023452-A2 CYCLOSPORIN ANALOGS FOR THE TREATMENT OF IMMUNOREGULATORY DISORDERS AND RESPIRATORY DISEASES ARRAY BIOPHARMA INC. (US) 2006-03-02 WO disclosed
US-20060035821-A1 Cyclosporin analogs for the treatment of immunoregulatory disorders and respiratory diseases ARRAY BIOPHARMA INC. 2006-02-16 US disclosed
US-20060035822-A1 Cyclosporin analogs for the treatment of immunoregulatory disorders and respiratory diseases ARRAY BIOPHARMA INC. 2006-02-16 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-20060035821-A1 Cyclosporin analogs for the treatment of immunoregulatory disorders and respiratory diseases TSLP, CHP1, IL2 KMT2A 4822/4885ALDH1A1 3651/4885MAPK1 4671/4885
US-20060035822-A1 Cyclosporin analogs for the treatment of immunoregulatory disorders and respiratory diseases TSLP, CHP1, IL2 KMT2A 4822/4885ALDH1A1 3651/4885MAPK1 4671/4885

“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.