SCHEMBL21662055

SCHEMBL21662055

COc1cccc(C2CCN(CCN)CC2)n1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 14/20 0.57
DRD4 P21917 12/20 0.57
HTR1A P08908 11/20 0.57
TLR9 Q9NR96 1/20 0.43
KCNH2 Q12809 5/20 0.43
OPRM1 P35372 1/20 0.42
OPRL1 P41146 1/20 0.42
DRD3 P35462 1/20 0.41
PRMT3 O60678 1/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
PRMT1 Q99873 1/20 0.40
PRMT8 Q9NR22 1/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
GLP1R P43220 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
Hydrochloric Acid SCHEMBL21642954 0.99 DRD2 (0.56) DRD2DRD4HTR1ATLR9KCNH2
SCHEMBL21662304 0.83 DRD4 (0.59) DRD2DRD4HTR1AKCNH2PRMT3
SCHEMBL17001861 0.83 DRD2 (0.52) DRD2DRD4HTR1ATLR9KCNH2
Hydrochloric Acid SCHEMBL21642961 0.82 DRD4 (0.58) DRD2DRD4HTR1AKCNH2PRMT3
SCHEMBL21661933 0.82 DRD2 (0.59) DRD2DRD4HTR1AKCNH2PRMT3
Hydrochloric Acid SCHEMBL21642940 0.81 DRD2 (0.58) DRD2DRD4HTR1AKCNH2PRMT3
SCHEMBL21699666 0.80 HTR1A (0.65) DRD2DRD4HTR1ATLR9KCNH2
SCHEMBL21662305 0.79 HTR1A (0.55) DRD2DRD4HTR1AKCNH2OPRM1
SCHEMBL12093559 0.79 DDB1 (0.56) DRD2DRD4HTR1AOPRM1OPRL1
Hydrochloric Acid SCHEMBL21642936 0.78 HTR1A (0.54) DRD2DRD4HTR1AKCNH2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230399308-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2023-12-14 US disclosed
US-20230399308-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE Sumitomo Pharma Co., Ltd. (JP) 2023-12-14 US disclosed
US-11780820-B2 2,6-disubstituted pyridine derivative Sumitomo Pharma Co., Ltd. (JP) 2023-10-10 US disclosed
US-11780820-B2 2,6-disubstituted pyridine derivative Sumitomo Pharma Co., Ltd. (JP) 2023-10-10 US disclosed
US-20210332025-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2021-10-28 US disclosed
US-11014905-B2 2,6-disubstituted pyridine derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2021-05-25 US disclosed
US-10800755-B2 2,6-disubstituted pyridine derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-10-13 US disclosed
US-20200239432-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-07-30 US disclosed
EP-3608314-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2020-02-12 EP disclosed
US-20200039952-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-02-06 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 (7 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-20210332025-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE CNR1, CNR2, CRHR1 DRD2 12/4885DRD4 29/4885HTR1A 7/4885
US-20200039952-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE CNR1, CNR2, CRHR1 DRD2 12/4885DRD4 29/4885HTR1A 7/4885
US-20230399308-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE CNR1, CNR2, CRHR1 DRD2 12/4885DRD4 29/4885HTR1A 7/4885
US-11014905-B2 2,6-disubstituted pyridine derivative CNR1, CNR2, CRHR1 DRD2 12/4885DRD4 29/4885HTR1A 7/4885
US-20200239432-A1 2,6-DISUBSTITUTED PYRIDINE DERIVATIVE CNR1, CNR2, CRHR1 DRD2 12/4885DRD4 29/4885HTR1A 7/4885
US-11780820-B2 2,6-disubstituted pyridine derivative CNR1, CNR2, CRHR1 DRD2 12/4885DRD4 29/4885HTR1A 7/4885
US-10800755-B2 2,6-disubstituted pyridine derivative CNR1, CNR2, CRHR1 DRD2 12/4885DRD4 29/4885HTR1A 7/4885

“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.