SCHEMBL4443007

SCHEMBL4443007

[O]C(=O)c1ccccc1C1CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
CYP2D6 P10635 1/20 0.40
KCNH2 Q12809 1/20 0.40
HSD17B10 Q99714 1/20 0.39
PIN1 Q13526 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
AKR1C3 P42330 1/20 0.37
AKR1C1 Q04828 1/20 0.37
ALDH1A1 P00352 2/20 0.37
ALOX15 P16050 1/20 0.37
NOTUM Q6P988 1/20 0.37
NPC1 O15118 2/20 0.36
HCRTR1 O43613 3/20 0.36
HCRTR2 O43614 3/20 0.36
RBP4 P02753 1/20 0.36
ADRA1A P35348 1/20 0.36
CYP2C9 P11712 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL1702632 0.90 PTGDR2 (0.49) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2
SCHEMBL7357951 0.84 ALDH1A1 (0.41) HSD17B10PIN1PTGDR2AKR1C3AKR1C1
SCHEMBL10457353 0.83 ALDH1A1 (0.54) CYP2D6AKR1C3AKR1C1ALDH1A1ALOX15
SCHEMBL30175300 0.83 ALDH1A1 (0.54) CYP2D6AKR1C3AKR1C1ALDH1A1ALOX15
SCHEMBL4109572 0.83 ALDH1A1 (0.54) CYP2D6AKR1C3AKR1C1ALDH1A1ALOX15
SCHEMBL23924941 0.81 HSD17B10 (0.38) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2
SCHEMBL16025390 0.81 NOTUM (0.42) HSD17B10PIN1ALDH1A1NOTUMNPC1
SCHEMBL9578253 0.81 RBP4 (0.38) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2
SCHEMBL161548 0.81 ADRA1A (0.51) HSD17B10ALDH1A1NPC1ADRA1ARAB9A
SCHEMBL16654184 0.81 ALDH1A1 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2

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-7629494-B2 Process for producing cyclopropylphenol derivative MITSUI CHEMICALS AGRO, INC. (JP) 2009-12-08 US disclosed
US-20090054681-A1 Production Process of cyclopropylphenol derivatives SANKYO AGRO COMPANY, LIMITED (JP) 2009-02-26 US disclosed
EP-1880987-A1 PROCESS FOR PRODUCING CYCLOPROPYLPHENOL DERIVATIVE Sankyo Agro Company, Limited (JP) 2008-01-23 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-20090054681-A1 Production Process of cyclopropylphenol derivatives CBR3, CYP4X1, CYP4A11 SLC6A2 3824/4885SLC6A4 1546/4885SLC6A3 1508/4885

“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.