SCHEMBL14224899

SCHEMBL14224899

CCC/C=C/C(CC)OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
USP2 O75604 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
PRKCA P17252 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GALR3 O60755 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
PTPN1 P18031 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31

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
SCHEMBL7939398 0.87 PRKCA (0.46) LMNAUSP2CYP3A4MAPTRECQL
SCHEMBL26982386 0.85 LMNA (0.36) LMNAUSP2CYP3A4MAPTRECQL
SCHEMBL7667124 0.84 TSHR (0.36) LMNAUSP2CYP3A4MAPTRECQL
SCHEMBL7667132 0.84 TSHR (0.36) LMNAUSP2CYP3A4MAPTRECQL
SCHEMBL11585861 0.82 CYP3A4 (0.38) LMNAUSP2CYP3A4MAPTRECQL
SCHEMBL11585857 0.82 CYP3A4 (0.38) LMNAUSP2CYP3A4MAPTRECQL
SCHEMBL30368256 0.81 GALR3 (0.47) GALR3
SCHEMBL10953136 0.81 ALDH1A1 (0.38) LMNAUSP2CYP3A4MAPTRECQL
SCHEMBL10953133 0.81 ALDH1A1 (0.38) LMNAUSP2CYP3A4MAPTRECQL
SCHEMBL7100990 0.80 TSHR (0.36) LMNAUSP2CYP3A4MAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946468-B2 Process for producing ester compound having an internal unsaturated bond or cyclic olefin JX NIPPON OIL & ENERGY CORPORATION (JP) 2015-02-03 US disclosed
US-8946468-B2 Process for producing ester compound having an internal unsaturated bond or cyclic olefin JX NIPPON OIL & ENERGY CORPORATION (JP) 2015-02-03 US disclosed
US-20120316360-A1 PROCESS FOR PRODUCING ESTER COMPOUND HAVING a,ß-UNSATURATED BOND OSAKA UNIVERSITY (JP) 2012-12-13 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-20120316360-A1 PROCESS FOR PRODUCING ESTER COMPOUND HAVING a,ß-UNSATURATED BOND COASY, OXER1, ACSL1 LMNA 4198/4885USP2 3615/4885CYP3A4 277/4885

“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.