SCHEMBL21964546

SCHEMBL21964546

Cc1cc(N)n(CCN2CCOCC2)n1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
POLB P06746 2/20 0.43
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
ILK Q13418 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
SYK P43405 1/20 0.38
KEAP1 Q14145 1/20 0.38
MAPT P10636 1/20 0.38
LMNA P02545 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
SCHEMBL22505581 0.80 SIGMAR1 (0.40) ILKLMNA
SCHEMBL21964594 0.77 POLB (0.40) POLBILKSMN1; SMN2SYKKEAP1
SCHEMBL1924976 0.77 ILK (0.39) ILKSMN1; SMN2KEAP1LMNA
SCHEMBL691318 0.73 POLB (0.51) L3MBTL1POLBMAPTLMNA
SCHEMBL21960869 0.73 L3MBTL1 (0.42) L3MBTL1POLBMAPT
SCHEMBL30860313 0.73 KDM4E (0.41) ILKMAPTLMNA
SCHEMBL21960837 0.72 L3MBTL1 (0.41) L3MBTL1POLBMAPT
SCHEMBL15048578 0.72 HPGDS (0.46) L3MBTL1ILK
SCHEMBL19635528 0.72 POLB (0.47) L3MBTL1POLBSMN1; SMN2LMNA
SCHEMBL17127621 0.71 P2RX7 (0.45) L3MBTL1POLBSMN1; SMN2KEAP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136311-B2 Heteroaromatic derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2021-10-05 US disclosed
EP-3478675-B1 HETEROAROMATIC DERIVATIVES AS NIK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-22 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 (1 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-11136311-B2 Heteroaromatic derivatives as NIK inhibitors NFKBIA, IKBKG, IKBKE L3MBTL1 2728/4885POLB 1088/4885CRHBP 4042/4885

“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.