SCHEMBL856657

SCHEMBL856657

CC(C)CCN1CCC(N)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.50
GNAO1 P09471 1/20 0.50
GNAI1 P63096 1/20 0.50
ARG1 P05089 1/20 0.40
ARG2 P78540 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
OPRL1 P41146 1/20 0.34
SIGMAR1 Q99720 2/20 0.33
KCNA3 P22001 1/20 0.33
PARP1 P09874 1/20 0.33
CCR5 P51681 1/20 0.33
HRH2 P25021 1/20 0.33
HRH1 P35367 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
MMP2 P08253 1/20 0.33
MMP8 P22894 1/20 0.33
SMN1; SMN2 Q16637 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
Hydrochloric Acid SCHEMBL856924 0.98 GNAI3 (0.53) GNAI3GNAO1GNAI1ARG1ARG2
SCHEMBL18575434 0.89 GNAI3 (0.40) GNAI3GNAO1GNAI1ARG1ARG2
SCHEMBL4144334 0.88 GNAI3 (0.56) GNAI3GNAO1GNAI1ARG1ARG2
SCHEMBL20648687 0.86 GNAI3 (0.59) GNAI3GNAO1GNAI1ARG1ARG2
SCHEMBL13519612 0.84 ARG1 (0.38) GNAI3GNAO1GNAI1ARG1ARG2
SCHEMBL25036354 0.84 GNAO1 (0.62) GNAI3GNAO1GNAI1ARG1ARG2
SCHEMBL22415214 0.82 GNAI3 (0.50) GNAI3GNAO1GNAI1ARG1ARG2
SCHEMBL20648690 0.81 GNAI3 (0.46) GNAI3GNAO1GNAI1SPHK1SIGMAR1
SCHEMBL8085877 0.80 CARM1 (0.52) SIGMAR1HRH3CARM1PRMT6PRMT1
SCHEMBL9974271 0.78 ARG1 (0.35) ARG1ARG2NOS3NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11370779-B2 Pharmaceutical composition for preventing or treating acute myeloid leukemia or metastatic breast cancer Pelemed Co., Ltd. (KR) 2022-06-28 US disclosed
US-20200270229-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING ACUTE MYELOID LEUKEMIA OR METASTATIC BREAST CANCER Pelemed Co., Ltd. (KR) 2020-08-27 US disclosed
CN-102414168-B Bridged spiro [2.4] heptane derivatives as ALX receptor and/or FPRL2 agonists ACTELION PHARMACEUTICALS LTD 2014-05-21 CN disclosed
US-8563714-B2 Bridged spiro [2.4] heptane derivatives as ALX receptor and/or FPRL2 agonists ACTELION PHARMACEUTICALS LTD. (CH) 2013-10-22 US disclosed
EP-2432760-B1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2013-07-17 EP disclosed
US-20120115841-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2012-05-10 US disclosed
CN-102414168-A Bridged spiro [2.4] heptane derivatives as ALX receptor and/or FPRL2 agonists ACTELION PHARMACEUTICALS LTD 2012-04-11 CN disclosed
EP-2432760-A1 BRIDGED SPIRO [2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-28 EP disclosed
WO-2010134014-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-11-25 WO disclosed
US-20080076762-A1 Novel 4-Aminopiperidine Derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2008-03-27 US disclosed
WO-2006056930-A2 NOVEL 4 -AMINOPIPERIDINE DERIVATIVES AS PLASMEPSIN II INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2006-06-01 WO disclosed
US-4153702-A Basically alkylated dithiosalicyclic acid amides and their use as medicaments BAYER AKTIENGESELLSCHAFT (DE) 1979-05-08 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 (4 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-20120115841-A1 BRIDGED SPIRO [2.4] HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS FPR1, FPR2, FPR3 GNAI3 1672/4885GNAO1 592/4885GNAI1 1334/4885
US-20200270229-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING ACUTE MYELOID LEUKEMIA OR METASTATIC BREAST CANCER FLT3, ABL1, MCL1 GNAI3 1147/4885GNAO1 3884/4885GNAI1 1237/4885
US-20080076762-A1 Novel 4-Aminopiperidine Derivatives METAP1, DNPEP, PEPD GNAI3 3721/4885GNAO1 2893/4885GNAI1 2247/4885
US-11370779-B2 Pharmaceutical composition for preventing or treating acute myeloid leukemia or metastatic breast cancer FLT3, ABL1, MCL1 GNAI3 1147/4885GNAO1 3884/4885GNAI1 1237/4885

“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.