SCHEMBL224697

SCHEMBL224697

CCOC(=O)c1cc(OC2CCCCO2)cc(OC2CCCCO2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
NPC1 O15118 2/20 0.44
HPGD P15428 2/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
ALOX15 P16050 1/20 0.42
MAPT P10636 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL3237592 0.88 ALDH1A1 (0.47) RAB9ACYP2C9CYP2C19NPC1HPGD
SCHEMBL15654561 0.87 RAB9A (0.53) RAB9ACYP2C9CYP2C19NPC1HPGD
SCHEMBL14422348 0.85 ALDH1A1 (0.51) RAB9ANPC1HPGDKMT2AMEN1
SCHEMBL18868394 0.81 ALDH1A1 (0.47) RAB9ANPC1HPGDKMT2AMEN1
SCHEMBL220900 0.80 KMT2A (0.51) HPGDKMT2AMEN1CREBBP
SCHEMBL4312331 0.80 CREBBP (0.52) RAB9ACYP2C9CYP2C19NPC1HPGD
SCHEMBL17052758 0.77 MEN1 (0.45) KMT2AMEN1ALDH1A1
SCHEMBL3868693 0.76 KMT2A (0.36) HPGDKMT2AMEN1ALDH1A1
SCHEMBL10830409 0.75 HPGD (0.41) RAB9AHPGDKMT2AMEN1KDM4E
SCHEMBL16406637 0.74 HPGD (0.39) RAB9ANPC1HPGDKMT2AMEN1

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
WO-2013022605-A1 MESOGENIC STABILIZERS TRANSITIONS OPTICAL, INC. (US) 2013-02-14 WO disclosed
US-8349210-B2 Mesogenic stabilizers TRANSITIONS OPTICAL, INC. (US) 2013-01-08 US disclosed
US-20120003401-A1 MESOGENIC STABILIZERS TRANSITIONS OPTICAL, INC. (US) 2012-01-05 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-20120003401-A1 MESOGENIC STABILIZERS PYM1, BMI1, C1S RAB9A 2624/4885CYP2C9 4629/4885CYP2C19 4543/4885

“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.