SCHEMBL21291301

SCHEMBL21291301

CCC(C)(C)N1CCC(N2CCOCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 4/20 0.35
OPRL1 P41146 2/20 0.35
ALDH1A1 P00352 3/20 0.33
CBX7 O95931 1/20 0.33
CDYL2 Q8N8U2 1/20 0.33
CDYL Q9Y232 1/20 0.33
CDY1; CDY1B Q9Y6F8 1/20 0.33
LMNA P02545 1/20 0.33
EPHX2 P34913 1/20 0.32
ACHE P22303 1/20 0.32
HRH3 Q9Y5N1 2/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
KDM2B Q8NHM5 1/20 0.31

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
SCHEMBL19966722 0.90 SMN1; SMN2 (0.34) L3MBTL3L3MBTL1SMN1; SMN2KDM4EOPRL1
SCHEMBL14044233 0.85 TSHR (0.35) KDM4EOPRL1ALDH1A1
SCHEMBL21004524 0.84 SMN1; SMN2 (0.33) L3MBTL3L3MBTL1SMN1; SMN2ACHE
SCHEMBL22921130 0.83 L3MBTL3 (0.38) L3MBTL3L3MBTL1HRH3
SCHEMBL22958088 0.81 L3MBTL3 (0.46) L3MBTL3L3MBTL1SMN1; SMN2KDM4EALDH1A1
SCHEMBL11916104 0.81 SMN1; SMN2 (0.40) L3MBTL3L3MBTL1SMN1; SMN2KDM4EOPRL1
SCHEMBL17393082 0.80 ALDH1A1 (0.38) L3MBTL1SMN1; SMN2ALDH1A1LMNA
SCHEMBL9921756 0.80 ALDH1A1 (0.38) L3MBTL1SMN1; SMN2ALDH1A1LMNA
SCHEMBL21214478 0.80 KDM4E (0.45) KDM4EOPRL1ALDH1A1HRH3
SCHEMBL21214477 0.80 L3MBTL1 (0.36) L3MBTL3L3MBTL1KDM4EOPRL1ALDH1A1

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-10647694-B2 Diphenylaminopyrimidine and triazine compound, and pharmaceutical composition and use thereof ARROMAX PHARMATECH CO., LTD. (CN) 2020-05-12 US disclosed
US-20190256493-A1 DIPHENYLAMINOPYRIMIDINE AND TRIAZINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF ARROMAX PHARMATECH CO., LTD. (CN) 2019-08-22 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 (2 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-20190256493-A1 DIPHENYLAMINOPYRIMIDINE AND TRIAZINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF ALK, CD2, TYRO3 L3MBTL3 2727/4885L3MBTL1 3945/4885SMN1; SMN2 4411/4885
US-10647694-B2 Diphenylaminopyrimidine and triazine compound, and pharmaceutical composition and use thereof ALK, CD2, TYRO3 L3MBTL3 2727/4885L3MBTL1 3945/4885SMN1; SMN2 4411/4885

“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.