SCHEMBL4332940

SCHEMBL4332940

Cc1ccc(COC(=O)N2CCNCC2C)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.52
GRIN2B Q13224 3/20 0.44
NAAA Q02083 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
P2RX4 Q99571 1/20 0.41
PDK1 Q15118 1/20 0.41
PDK2 Q15119 1/20 0.41
PDK3 Q15120 1/20 0.41
PDK4 Q16654 1/20 0.41
MMP2 P08253 2/20 0.40
MMP12 P39900 2/20 0.40
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
DPP4 P27487 1/20 0.39
GFER P55789 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
SCHEMBL583648 0.88 HTR2C (0.67) HTR2CMEN1KMT2APDK1PDK2
SCHEMBL523993 0.88 HTR2C (0.67) HTR2CMEN1KMT2APDK1PDK2
SCHEMBL1191153 0.88 HTR2C (0.67) HTR2CMEN1KMT2APDK1PDK2
Hydrochloric Acid SCHEMBL28775183 0.87 HTR2C (0.66) HTR2CMEN1KMT2APDK1PDK2
Hydrochloric Acid SCHEMBL523994 0.87 HTR2C (0.66) HTR2CMEN1KMT2APDK1PDK2
Hydrochloric Acid SCHEMBL523992 0.87 HTR2C (0.66) HTR2CMEN1KMT2APDK1PDK2
SCHEMBL8435747 0.84 HTR2C (0.47) HTR2C
SCHEMBL8437972 0.84 HTR2C (0.47) HTR2C
SCHEMBL8438157 0.84 HTR2C (0.47) HTR2C
SCHEMBL4680459 0.83 HTR2C (0.46) HTR2CMEN1KMT2APDK1PDK2

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-7569690-B2 Process for producing oxycarbonyl-substituted piperazine derivative TORAY FINE CHEMICALS CO., LTD. (JP) 2009-08-04 US disclosed
US-20060161003-A1 Process for producing oxycarbonyl-substituted piperazine derivative TORAY FINE CHEMICALS CO., LTD. (JP) 2006-07-20 US disclosed
EP-1548010-A1 PROCESS FOR PRODUCING OXYCARBONYL-SUBSTITUTED PIPERAZINE DERIVATIVE Toray Fine Chemicals Co., Ltd. (JP) 2005-06-29 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-20060161003-A1 Process for producing oxycarbonyl-substituted piperazine derivative DHPS, AQP4, OGFOD1 HTR2C 1230/4885GRIN2B 3789/4885NAAA 1470/4885

“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.