SCHEMBL13588644

SCHEMBL13588644

Cc1ccc(CN(C)C(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PYCR1 P32322 2/20 0.47
▸ SLC6A2 P23975 2/20 0.44
▸ SLC6A4 P31645 2/20 0.44
▸ ADRA2B P18089 1/20 0.44
▸ ADRA2C P18825 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ ADRA1A P35348 1/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ CNR2 P34972 3/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ LIPE Q05469 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ TAAR1 Q96RJ0 1/20 0.38
▸ CHRNA7 P36544 1/20 0.38

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
SCHEMBL21127229 0.91 ADRA2B (0.50) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL14174895 0.82 MEN1 (0.47) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL23059839 0.80 PYCR1 (0.55) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL2582095 0.80 ADRA2B (0.42) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL25640176 0.80 PYCR1 (0.46) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL24973992 0.80 HTR2A (0.52) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL13532083 0.80 PYCR1 (0.48) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL19033246 0.80 ALDH1A1 (0.54) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL5204980 0.80 MAPT (0.46) PYCR1SLC6A2SLC6A4ADRA2BADRA2C
SCHEMBL819942 0.79 HDAC1 (0.52) PYCR1SLC6A2SLC6A4CNR2IDO1

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-20140283199-A1 Signaling Compositions, Methods, and Systems for Effecting Plant Burndown and Herbicide Enhancement KamTec (US) 2014-09-18 — — US claimed
US-20230242565-A1 Macrolides with Modified Desosamine Sugars and Uses Thereof ZIKANI THERAPEUTICS, INC. 2023-08-03 — — US disclosed
US-11673910-B2 Macrolides with modified desosamine sugars and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2023-06-13 — — US disclosed
US-20190092758-A1 BLOCKING TOLL-LIKE RECEPTOR 9 SIGNALING WITH SMALL MOLECULE ANTAGONIST COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2019-03-28 — — US disclosed
EP-1950199-B1 Proline derivatives and use thereof as drugs MITSUBISHI TANABE PHARMA CORP (JP) 2009-12-02 — — EP disclosed
EP-1857459-A2 Pyrazolopyrimidine compound and a process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 2007-11-21 — — 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 (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-11673910-B2 Macrolides with modified desosamine sugars and uses thereof FUT6, DDOST, MGAM PYCR1 3487/4885SLC6A2 4089/4885SLC6A4 2681/4885
US-20190092758-A1 BLOCKING TOLL-LIKE RECEPTOR 9 SIGNALING WITH SMALL MOLECULE ANTAGONIST TLR9, TLR1, TLR3 PYCR1 3481/4885SLC6A2 3671/4885SLC6A4 2287/4885
US-20230242565-A1 Macrolides with Modified Desosamine Sugars and Uses Thereof FUT6, DDOST, MGAM PYCR1 3487/4885SLC6A2 4089/4885SLC6A4 2681/4885
US-20140283199-A1 Signaling Compositions, Methods, and Systems for Effecting Plant Burndown and Herbicide Enhancement BOLA2; BOLA2B, DBNL, EBPL PYCR1 3633/4885SLC6A2 3277/4885SLC6A4 2753/4885

“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.

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