SCHEMBL1574497

SCHEMBL1574497

CC(C)N(C(C)C)C1CN(C(=O)Nc2cccc(F)c2)C1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
CYP2D6 P10635 4/20 0.53
NPC1 O15118 1/20 0.53
PAX8 Q06710 3/20 0.53
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP2C9 P11712 1/20 0.51
USP2 O75604 3/20 0.50
ALOX15 P16050 2/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
TRPV1 Q8NER1 1/20 0.48
CYP3A4 P08684 4/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL1573328 0.87 ALDH1A1 (0.59) ALDH1A1MAPTSMN1; SMN2
SCHEMBL1575047 0.87 CYP2D6 (0.55) ALDH1A1CYP2D6NPC1PAX8CYP1A2
SCHEMBL1575149 0.87 CACNA1H (0.46) PAX8
SCHEMBL1574854 0.86 GRIN2B (0.59) POLBMAPTTRPV1SMN1; SMN2
SCHEMBL1575244 0.86 ALDH1A1 (0.58) ALDH1A1NPC1ALOX15MAPTSMN1; SMN2
SCHEMBL1574679 0.85 PAX8 (0.49) ALDH1A1CYP2D6NPC1PAX8CYP1A2
SCHEMBL1574936 0.85 KMT2A (0.52) ALDH1A1NPC1POLBMAPTSMN1; SMN2
SCHEMBL1574702 0.85 GRIN2B (0.52) ALDH1A1NPC1CYP2C19CYP2C9POLB
SCHEMBL1574799 0.84 MAPT (0.59) ALDH1A1CYP2D6CYP1A2CYP2C19CYP2C9
SCHEMBL1575200 0.84 CYP2D6 (0.52) ALDH1A1CYP2D6NPC1PAX8CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2308562-A2 Azetidine ring compounds and drugs comprising the same Ono Pharmaceutical Co., Ltd. (JP) 2011-04-13 EP disclosed
US-7511159-B2 Azetidine ring compounds and drugs comprising the same ONO PHARMACEUTICAL CO., LTD. (JP) 2009-03-31 US disclosed
US-20070135402-A1 Azetidine ring compounds and drugs comprising the same ONO PHARMACEUTICAL CO., LTD. (JP) 2007-06-14 US disclosed
EP-1698375-A1 AZETIDINE RING COMPOUNDS AND DRUGS COMPRISING THE SAME ONO PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 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-20070135402-A1 Azetidine ring compounds and drugs comprising the same EDNRA, LIPG, EDNRB ALDH1A1 1445/4885CYP2D6 354/4885NPC1 413/4885

“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.