SCHEMBL11650754

SCHEMBL11650754

CCC[C@H]1CN[C@H](C(=O)O)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 2/20 0.64
DPP4 P27487 1/20 0.49
CYP1A2 P05177 3/20 0.48
ALOX15 P16050 3/20 0.48
CYP2C19 P33261 3/20 0.48
CYP2D6 P10635 3/20 0.48
SLC1A3 P43003 1/20 0.48
SLC1A2 P43004 1/20 0.48
SLC1A1 P43005 1/20 0.48
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
THRB P10828 2/20 0.41
ALDH1A1 P00352 2/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIA1 P42261 1/20 0.41
GRIA2 P42262 1/20 0.41
GRIA3 P42263 1/20 0.41
GRIA4 P48058 1/20 0.41
GRIN1 Q05586 1/20 0.41

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
SCHEMBL3776510 1.00 ARG1 (0.64) ARG1DPP4CYP1A2ALOX15CYP2C19
SCHEMBL26118062 1.00 ARG1 (0.64) ARG1DPP4CYP1A2ALOX15CYP2C19
SCHEMBL1034091 1.00 ARG1 (0.64) ARG1DPP4CYP1A2ALOX15CYP2C19
SCHEMBL5511790 0.89 ARG1 (0.60) ARG1DPP4CYP1A2ALOX15CYP2C19
SCHEMBL3787271 0.89 ARG1 (0.60) ARG1DPP4CYP1A2ALOX15CYP2C19
SCHEMBL4867875 0.87 ARG1 (0.58) ARG1DPP4CYP1A2ALOX15CYP2C19
SCHEMBL3780786 0.87 ARG1 (0.58) ARG1DPP4CYP1A2ALOX15CYP2C19
SCHEMBL7442641 0.84 ARG1 (0.58) ARG1CYP1A2ALOX15CYP2C19CYP2D6
SCHEMBL7411388 0.84 ARG1 (0.58) ARG1CYP1A2ALOX15CYP2C19CYP2D6
SCHEMBL3781411 0.84 ARG1 (0.58) ARG1CYP1A2ALOX15CYP2C19CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10590159-B2 Lincomycin biosynthetic intermediates, method for preparation, and use thereof SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2020-03-17 US disclosed
US-9982016-B2 NPR-B agonists SHIRE ORPHAN THERAPIES GMBH (DE) 2018-05-29 US disclosed
US-9822147-B2 Methods of treating ophthalmic diseases using NPR-B agonists SHIRE ORPHAN THERAPIES GMBH (DE) 2017-11-21 US disclosed
US-20170313743-A1 NPR-B Agonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-11-02 US disclosed
US-9745344-B2 NPR-B agonists SHIRE ORPHAN THERAPIES GMBH (DE) 2017-08-29 US disclosed
US-20160194357-A1 Novel NPR-B Agonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-07-07 US disclosed
US-9187525-B2 Methods of treating ophthalmic diseases using NPR-B agonists SHIRE ORPHAN THERAPIES GMBH (DE) 2015-11-17 US disclosed
US-9169293-B2 NPR-B agonists Shire Orphan Thereapies GmbH (DE) 2015-10-27 US disclosed
US-8551938-B2 NPR-B agonists ALCON RESEARCH, LTD. (US) 2013-10-08 US disclosed
US-20110112038-A1 NOVEL NPR-B AGONISTS ALCON RESEARCH, LTD. (US) 2011-05-12 US disclosed
US-RE29558-E Lincomycin analogs THE UPJOHN COMPANY (US) 1978-02-28 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-10590159-B2 Lincomycin biosynthetic intermediates, method for preparation, and use thereof COASY, DHPS, DCXR ARG1 4275/4885DPP4 3486/4885CYP1A2 612/4885
US-20170313743-A1 NPR-B Agonists NPR1, NPR3, NPBWR1 ARG1 640/4885DPP4 710/4885CYP1A2 4279/4885
US-20160194357-A1 Novel NPR-B Agonists NPR1, NPR3, NPBWR1 ARG1 680/4885DPP4 683/4885CYP1A2 4306/4885
US-20110112038-A1 NOVEL NPR-B AGONISTS NPR1, NPR3, NPBWR1 ARG1 680/4885DPP4 683/4885CYP1A2 4306/4885

“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.