SCHEMBL17035440

SCHEMBL17035440

CNC(=O)N1CC2CCC1C2

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOST Q9BQB4 1/20 0.36
POLB P06746 1/20 0.35
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
RAB9A P51151 6/20 0.31
NPC1 O15118 5/20 0.31
KMT2A Q03164 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL3231502 0.82 CHRNB2 (0.39) SOSTPOLBCHRNB2CHRNA4CHRNB4
SCHEMBL17032812 0.81 CHRNB2 (0.38) SOSTCHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL25010722 0.78 CHRNB2 (0.39) CHRNB2CHRNA4CHRNB4CHRNA3RAB9A
SCHEMBL17037033 0.78 CHRNB2 (0.39) CHRNB2CHRNA4CHRNB4CHRNA3RAB9A
SCHEMBL17038774 0.77 TSHR (0.48) CHRNB2CHRNA4CHRNB4CHRNA3RAB9A
SCHEMBL17057328 0.75 RAB9A (0.33) CHRNB2CHRNA4CHRNB4CHRNA3RAB9A
SCHEMBL5501263 0.75 RAB9A (0.33) CHRNB2CHRNA4CHRNB4CHRNA3RAB9A
SCHEMBL18312023 0.75 RAB9A (0.33) CHRNB2CHRNA4CHRNB4CHRNA3RAB9A
SCHEMBL22553973 0.74 RAB9A (0.35) CHRNB2CHRNA4RAB9ANPC1KMT2A
SCHEMBL29974600 0.74 POLB (0.50) POLBCHRNB2CHRNA4CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117203202-A Quinoxaline derivative and use thereof 黑钻治疗公司 2023-12-08 CN disclosed
US-20170226142-A1 Factor D Inhibitors Useful for Treating Inflammatory Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-08-10 US disclosed
US-9643986-B2 Factor D inhibitors useful for treating inflammatory disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-05-09 US disclosed
US-20160362399-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2016-12-15 US disclosed
US-20160362432-A1 PHOSPHONATE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2016-12-15 US disclosed
US-20160362398-A1 AMIDE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2016-12-15 US disclosed
US-20160362433-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2016-12-15 US disclosed
US-20150239837-A1 Factor D Inhibitors Useful for Treating Inflammatory Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2015-08-27 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 (6 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-20160362433-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, C9, TFPI SOST 3987/4885POLB 4107/4885CHRNB2 4297/4885
US-20160362398-A1 AMIDE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, TFPI, CFH SOST 3361/4885POLB 3554/4885CHRNB2 4473/4885
US-20160362432-A1 PHOSPHONATE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, CFH, TFPI SOST 1965/4885POLB 1498/4885CHRNB2 4215/4885
US-20150239837-A1 Factor D Inhibitors Useful for Treating Inflammatory Disorders CFD, TFPI, TFPI2 SOST 3530/4885POLB 3781/4885CHRNB2 3766/4885
US-20170226142-A1 Factor D Inhibitors Useful for Treating Inflammatory Disorders CFD, TFPI, TFPI2 SOST 3530/4885POLB 3781/4885CHRNB2 3766/4885
US-20160362399-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, CFH, TFPI SOST 3788/4885POLB 3762/4885CHRNB2 4010/4885

“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.