SCHEMBL7111024

SCHEMBL7111024

CCOC(=O)C(O)CC1(C)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.34
HSD17B10 Q99714 1/20 0.34
ALOX15 P16050 3/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
SOAT1 P35610 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HIF1A Q16665 1/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33
CAD P27708 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL7112218 0.82 SMN1; SMN2 (0.33) KMT2AALDH1A1TSHRPOLB
SCHEMBL4701863 0.78 ALDH1A1 (0.34) L3MBTL1KMT2AALDH1A1LMNAHSD17B10
SCHEMBL27392587 0.77 POLB (0.34) L3MBTL1KMT2AALDH1A1LMNAHSD17B10
SCHEMBL19727158 0.77 CAD (0.38) L3MBTL1KMT2AALDH1A1LMNAHSD17B10
SCHEMBL4000838 0.76 CPB2 (0.39) L3MBTL1KMT2AALDH1A1LMNAHSD17B10
SCHEMBL14577537 0.76 CYP3A4 (0.36) KMT2AALDH1A1LMNAHSD17B10ALOX15
SCHEMBL7107840 0.74 OR51E2 (0.40) TSHR
SCHEMBL544994 0.71
SCHEMBL1783372 0.71
SCHEMBL3360225 0.71

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-6528503-B2 Anticoagulants MERCK & CO., INC. 2003-03-04 US disclosed
US-20030013700-A1 Thrombin inhibitors MERCK SHARP & DOHME CORP. 2003-01-16 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 (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-20030013700-A1 Thrombin inhibitors TFPI, PLAT, TFPI2 L3MBTL1 3358/4885KMT2A 598/4885ALDH1A1 2961/4885

“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.