SCHEMBL6771297

SCHEMBL6771297

CCOC(=O)C1C(c2ccc(OC)cc2)CC(=O)N1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HSD17B2 P37059 3/20 0.47
KMT2A Q03164 2/20 0.47
TSHR P16473 2/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 5/20 0.45
LMNA P02545 2/20 0.45
KDM4E B2RXH2 2/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
FPR1 P21462 1/20 0.41
FPR2 P25090 1/20 0.41
USP2 O75604 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP2C19 P33261 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL6771299 1.00 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2HSD17B2KMT2ATSHR
SCHEMBL6767974 0.87 KDM4E (0.43) ALDH1A1SMN1; SMN2HSD17B2KMT2ATSHR
SCHEMBL6767977 0.87 KDM4E (0.43) ALDH1A1SMN1; SMN2HSD17B2KMT2ATSHR
SCHEMBL6773142 0.86 SLC6A4 (0.41) CYP2C19
SCHEMBL6771313 0.86 CYP19A1 (0.41) SMN1; SMN2HSD17B2KMT2AMEN1GAA
SCHEMBL6772031 0.86 CYP19A1 (0.41) SMN1; SMN2HSD17B2KMT2AMEN1GAA
SCHEMBL6773138 0.86 SLC6A4 (0.41) CYP2C19
SCHEMBL6771317 0.86 CYP19A1 (0.41) SMN1; SMN2HSD17B2KMT2AMEN1GAA
SCHEMBL6768953 0.86 MEN1 (0.48) ALDH1A1SMN1; SMN2HSD17B2KMT2ATSHR
SCHEMBL6768951 0.86 MEN1 (0.48) ALDH1A1SMN1; SMN2HSD17B2KMT2ATSHR

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-6784167-B2 TREATING OSTEOPOROSIS, OSTEOPENIA, OVARIAN CANCER, BREAST CANCER, ENDOMETRIAL CANCER, ENDOMETRIOSIS, PROSTATE CANCER, ACNE, ANDROGEN-DEPENDENT HAIR LOSS, NON-INSULIN-DEPENDENT DIABETES MELLITUS, OR HYPERCHOLESTEROLEMIA. BAYER PHARMACEUTICALS CORPORATION 2004-08-31 US disclosed
US-20030087952-A1 17-Beta-hydroxysteroid dehydrogenase-II inhibitors BAYER PHARMACEUTICALS CORPORATION 2003-05-08 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 (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-20030087952-A1 17-Beta-hydroxysteroid dehydrogenase-II inhibitors HSD3B1, HSD3B2, HSD17B1 ALDH1A1 86/4885SMN1; SMN2 3120/4885HSD17B2 4/4885

“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.