SCHEMBL6839655

SCHEMBL6839655

CCOC(=O)C(C(=O)OCC)C1CCC(C)CC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.56
ALDH1A1 P00352 4/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TSHR P16473 3/20 0.45
KDM4E B2RXH2 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34

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
SCHEMBL9209640 0.94 L3MBTL1 (0.61) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL9451713 0.85 L3MBTL1 (0.58) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL334541 0.85 ALDH1A1 (0.59) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL24883119 0.84 L3MBTL1 (0.53) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL6839619 0.84 L3MBTL1 (0.53) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL21834562 0.83 L3MBTL1 (0.51) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL18022794 0.83 ALDH1A1 (0.62) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL1433202 0.83 ALDH1A1 (0.62) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL31409193 0.83 ALDH1A1 (0.62) L3MBTL1ALDH1A1NPSR1TSHRKDM4E
SCHEMBL3385655 0.83 L3MBTL1 (0.51) L3MBTL1ALDH1A1NPSR1TSHRKDM4E

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-6759103-B2 NEMATIC, CHOLESTERIC OR CHIRAL SMECTIC LIQUID-CRYSTAL MIXTURES HAVING HIGH ABSOLUTE DIELECTRIC ANISOTROPY VALUES AND WITH A FAVORABLE VISCOSITY/CLEARING POINT RELATIONSHIP; PHOTOSTABILITY; HEAT AND ULTRAVIOLET RADIATION RESISTANCE CLARIANT FINANCI (BVI) LIMITED (VG) 2004-07-06 US disclosed
US-20030091756-A1 Nematic, cholesteric or chiral smectic liquid-crystal mixtures having high absolute dielectric anisotropy values and with a favorable viscosity/clearing point relationship; photostability; heat and ultraviolet radiation resistance CLARIANT INTERNATIONAL LTD. 2003-05-15 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-20030091756-A1 Nematic, cholesteric or chiral smectic liquid-crystal mixtures having high absolute dielectric anisotropy values and with a favorable viscosity/clearing point relationship; photostability; heat and ultraviolet radiation resistance SCO2, CNOT1, HCFC1 L3MBTL1 313/4885ALDH1A1 1699/4885NPSR1 4390/4885

“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.