SCHEMBL2980232

SCHEMBL2980232

CCOC(=O)N1C=C(OCc2ccccc2)C(C)C1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.41
NR1H4 Q96RI1 1/20 0.41
MAPT P10636 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
EGFR P00533 2/20 0.40
CCR8 P51685 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR5 Q9H228 1/20 0.39

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
SCHEMBL2985999 0.87 L3MBTL1 (0.42) HTR2CL3MBTL1LMNAALDH1A1NR1H4
SCHEMBL14778992 0.76 HTR2C (0.51) HTR2CL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL2983787 0.72 HTR2C (0.46) HTR2CL3MBTL1LMNAALDH1A1NR1H4
SCHEMBL6819973 0.68 SMN1; SMN2 (0.48) HTR2CL3MBTL1LMNAALDH1A1MEN1
SCHEMBL16356837 0.68 POLB (0.52) HTR2CL3MBTL1LMNAKDM4E
SCHEMBL7658562 0.67 L3MBTL1 (0.68) L3MBTL1ALDH1A1MAPTMEN1KMT2A
SCHEMBL10053573 0.67 HTR2C (0.64) HTR2CALDH1A1MEN1KMT2A
SCHEMBL5517077 0.67 HTR2C (0.64) HTR2CALDH1A1MEN1KMT2A
SCHEMBL5517082 0.67 HTR2C (0.64) HTR2CALDH1A1MEN1KMT2A
SCHEMBL8562576 0.67 KMT2A (0.48) HTR2CL3MBTL1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1950198-B1 PROCESS FOR PRODUCTION OF BENZYLOXYPYRROLIDINE DERIVATIVE, AND PROCESS FOR PRODUCTION OF HYDROCHLORIDE SALT POWDER OF OPTICALLY ACTIVE BENZYLOXYPYRROLIDINE DERIVATIVE TORAY FINECHEMICALS CO LTD (JP) 2014-08-06 EP disclosed
US-7772406-B2 Process for production of benzyloxypyrrolidine derivative, and process for production of hydrochloride salt powder of optically active benzyloxypyrrolidine derivative TORAY FINE CHEMICALS CO., LTD. (JP) 2010-08-10 US disclosed
US-20090093643-A1 Process for Production of Benzyloxypyrrolidine Derivative, and Process for Production of Hydrochloride Salt Powder of Optically Active Benzyloxypyrrolidine Derivative TORAY FINE CHEMICALS CO., LTD. (JP) 2009-04-09 US disclosed
EP-1950198-A1 PROCESS FOR PRODUCTION OF BENZYLOXYPYRROLIDINE DERIVATIVE, AND PROCESS FOR PRODUCTION OF HYDROCHLORIDE SALT POWDER OF OPTICALLY ACTIVE BENZYLOXYPYRROLIDINE DERIVATIVE Toray Fine Chemicals Co., Ltd. (JP) 2008-07-30 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-20090093643-A1 Process for Production of Benzyloxypyrrolidine Derivative, and Process for Production of Hydrochloride Salt Powder of Optically Active Benzyloxypyrrolidine Derivative HPD, PAH, DHPS HTR2C 1924/4885L3MBTL1 3977/4885LMNA 4004/4885

“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.