SCHEMBL873559

SCHEMBL873559

O=C(O)CN1CCC(CO)C1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.43
ARG2 P78540 1/20 0.43
HSD17B10 Q99714 1/20 0.39
CYP2D6 P10635 1/20 0.36
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
ACE P12821 1/20 0.33
ITGB3 P05106 2/20 0.32
ITGA2B P08514 2/20 0.32
CHRM3 P20309 1/20 0.32

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
SCHEMBL2137507 1.00 ARG1 (0.43) ARG1ARG2HSD17B10CYP2D6CYP3A4
SCHEMBL877773 1.00 ARG1 (0.43) ARG1ARG2HSD17B10CYP2D6CYP3A4
SCHEMBL18173237 0.88 HSD17B10 (0.47) ARG1ARG2HSD17B10ITGB3ITGA2B
SCHEMBL12635338 0.82 KDM4E (0.42) ARG1ARG2CYP2D6CYP3A4CYP2C19
SCHEMBL14671205 0.82 HSD17B10 (0.38) HSD17B10CHRM3
SCHEMBL1006825 0.82 KDM4E (0.42) ARG1ARG2CYP2D6CYP3A4CYP2C19
SCHEMBL1008629 0.82 KDM4E (0.42) ARG1ARG2CYP2D6CYP3A4CYP2C19
SCHEMBL19616627 0.79 MEN1 (0.44) ARG1ARG2CYP2D6
SCHEMBL19637427 0.79 MEN1 (0.44) ARG1ARG2CYP2D6
SCHEMBL7359289 0.76 HSD17B10 (0.44) HSD17B10ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9624200-B2 Therapeutic piperazines DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2017-04-18 US disclosed
US-20150087645-A1 THERAPEUTIC PIPERAZINES HELICON THERAPEUTICS, INC. 2015-03-26 US disclosed
US-8927546-B2 Therapeutic piperazines DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2015-01-06 US disclosed
EP-2643000-A2 THERAPEUTIC PIPERAZINES Dart Neuroscience (Cayman) Ltd (KY) 2013-10-02 EP disclosed
WO-2012040258-A2 THERAPEUTIC PIPERAZINES HELICON THERAPEUTICS, INC. (US) 2012-03-29 WO disclosed
US-20110065691-A1 THERAPEUTIC PIPERAZINES DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2011-03-17 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 (2 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-20150087645-A1 THERAPEUTIC PIPERAZINES PDE4A, PDE4B, PDE4D ARG1 170/4885ARG2 117/4885HSD17B10 2919/4885
US-20110065691-A1 THERAPEUTIC PIPERAZINES PDE4A, PDE4B, PDE4D ARG1 170/4885ARG2 117/4885HSD17B10 2919/4885

“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.