SCHEMBL14320911

SCHEMBL14320911

CCCCCCCCCCCCCCCCCC(C)(C)P=O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 6/20 0.41
FDPS P14324 9/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
SMPD1 P17405 2/20 0.39
CES2 O00748 1/20 0.39
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39

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
SCHEMBL314067 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL315227 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL992535 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL992551 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL314021 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL535649 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL8581895 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL992088 1.00 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1
SCHEMBL8330823 0.97 FDPS (0.38) GGPS1FDPSSMPD1CES2LPAR1
SCHEMBL10601688 0.80 GGPS1 (0.41) GGPS1FDPSTSHRTHRBSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9056313-B2 Catalysts for the production of hydroxy ether hydrocarbons by vapor phase hydrogenolysis of cyclic acetals and ketals EASTMAN CHEMICAL COMPANY (US) 2015-06-16 US disclosed
US-9000229-B2 Production of hydroxy ether hydrocarbons by vapor phase hydrogenolysis of cyclic acetals and ketals EASTMAN CHEMICAL COMPANY (US) 2015-04-07 US disclosed
WO-2012177602-A1 PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY VAPOR PHASE HYDROGENOLYSIS OF CYCLIC ACETALS AND KETALS EASTMAN CHEMICAL COMPANY (US) 2012-12-27 WO disclosed
WO-2012177484-A1 CATALYSTS FOR THE PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY VAPOR PHASE HYDROGENOLYSIS OF CYCLIC ACETALS AND KETALS EASTMAN CHEMICAL COMPANY (US) 2012-12-27 WO disclosed
US-20120330067-A1 CATALYSTS FOR THE PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY VAPOR PHASE HYDROGENOLYSIS OF CYCLIC ACETALS AND KETALS EASTMAN CHEMICAL COMPANY (US) 2012-12-27 US disclosed
US-20120330066-A1 PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY VAPOR PHASE HYDROGENOLYSIS OF CYCLIC ACETALS AND KETALS EASTMAN CHEMICAL COMPANY (US) 2012-12-27 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-20120330067-A1 CATALYSTS FOR THE PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY VAPOR PHASE HYDROGENOLYSIS OF CYCLIC ACETALS AND KETALS SUV39H2, KAT5, SUV39H1 GGPS1 3463/4885FDPS 4372/4885TSHR 4045/4885
US-20120330066-A1 PRODUCTION OF HYDROXY ETHER HYDROCARBONS BY VAPOR PHASE HYDROGENOLYSIS OF CYCLIC ACETALS AND KETALS SUV39H1, HDHD5, SUV39H2 GGPS1 2823/4885FDPS 3744/4885TSHR 4429/4885

“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.