SCHEMBL9449043

SCHEMBL9449043

CCC(OC)C(CO)OC

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.31
MGAM O43451 1/20 0.31
CNR1 P21554 1/20 0.31
ADRA1A P35348 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TSHR P16473 2/20 0.30

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
SCHEMBL20876354 0.87 TSHR (0.38) MGAMTDP1TSHR
SCHEMBL29012727 0.87 TSHR (0.38) MGAMTDP1TSHR
SCHEMBL9511317 0.87 TSHR (0.38) MGAMTDP1TSHR
SCHEMBL10409177 0.87 TSHR (0.38) MGAMTDP1TSHR
SCHEMBL7417972 0.87 TSHR (0.38) MGAMTDP1TSHR
SCHEMBL10309515 0.84 LMNA (0.33) LMNATSHR
SCHEMBL13672319 0.84 LMNA (0.33) LMNATSHR
SCHEMBL16994582 0.78
SCHEMBL3744813 0.78
SCHEMBL13951959 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170119806-A1 ARYLNAPHTHALENE LACTONE DERIVATIVES AND METHODS OF MAKING AND USING THEREOF NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2017-05-04 US disclosed
US-5243065-A Exhibit ferroelectricity; optoelectronics, display devices IDEMITSU KOSAN CO., LTD. (JP) 1993-09-07 US disclosed
EP-0362714-B1 LIQUID-CRYSTALLINE COMPOUNDS AND LIQUID-CRYSTALLINE POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-03-24 EP disclosed
US-5190687-A Polyepoxide or polyether polymers with ester groups that exhibit ferroelectricity with high speed response to electric fields IDEMITSU KOSAN CO., LTD. (JP) 1993-03-02 US disclosed
EP-0362714-A2 Liquid-crystalline compounds and liquid-crystalline polymers IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-04-11 EP 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-20170119806-A1 ARYLNAPHTHALENE LACTONE DERIVATIVES AND METHODS OF MAKING AND USING THEREOF PGLS, NAPEPLD, PLCD1 LMNA 1671/4885MGAM 1572/4885CNR1 2956/4885

“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.