SCHEMBL2610470

SCHEMBL2610470

CC(O)[C@@]1(c2cccc(F)c2)C[C@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
CYP3A4 P08684 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SMYD2 Q9NRG4 2/20 0.34
GRIN2B Q13224 4/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
OPRM1 P35372 2/20 0.33
OPRL1 P41146 2/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
CHRNA1 P02708 1/20 0.33
CHRNB1 P11230 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33

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
SCHEMBL2118616 0.81 HTR2A (0.37) CCR2HTR2AHTR2CHTR2BCYP3A4
SCHEMBL2118621 0.81 HTR2A (0.37) CCR2HTR2AHTR2CHTR2BCYP3A4
SCHEMBL2610469 0.80 HCRTR1 (0.36) CYP3A4HTTSMN1; SMN2
SCHEMBL2610471 0.80 HCRTR1 (0.36) CYP3A4HTTSMN1; SMN2
SCHEMBL2118280 0.78 HTR2A (0.36) CCR2HTR2AHTR2CHTR2BCYP3A4
SCHEMBL2610455 0.75 SLC6A2 (0.41) CCR2HTR2AHTR2CHTR2BGRIN2B
SCHEMBL2610410 0.74 CYP3A4 (0.37) CYP3A4HTTSMN1; SMN2SMYD2OPRK1
SCHEMBL2116884 0.72 HCRTR1 (0.52)
SCHEMBL15161952 0.71 HCRTR1 (0.40) CYP3A4HTTSMN1; SMN2
SCHEMBL2610407 0.71 OPRK1 (0.37) CCR2CYP3A4HTTSMN1; SMN2SMYD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268848-B2 Cyclopropane compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-18 US disclosed
US-20120095031-A1 CYCLOPROPANE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-19 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-20120095031-A1 CYCLOPROPANE COMPOUND HCRTR1, HCRTR2, CNR1 CCR2 267/4885HTR2A 129/4885HTR2C 109/4885

“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.