SCHEMBL1574852

SCHEMBL1574852

Cc1ccc(C)c(NC(=O)N2CC(N3CCC4(CC3)OCCO4)C2)c1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.59
THRB P10828 1/20 0.49
ALDH1A1 P00352 5/20 0.48
POLB P06746 3/20 0.48
RAB9A P51151 3/20 0.47
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 1/20 0.42
CYP1A2 P05177 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GRIN2B Q13224 1/20 0.41
MEN1 O00255 1/20 0.40

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
SCHEMBL1575119 0.91 RAB9A (0.57) TP53THRBALDH1A1POLBRAB9A
SCHEMBL1575156 0.87 KDM4E (0.54) TP53ALDH1A1POLBKDM4EKMT2A
SCHEMBL1576042 0.85 TP53 (0.65) TP53THRBALDH1A1RAB9AKMT2A
SCHEMBL1575247 0.84 KMT2A (0.57) ALDH1A1POLBRAB9AKMT2ASMN1; SMN2
SCHEMBL4492029 0.84 TP53 (0.80) TP53THRBRAB9AKMT2ANPC1
SCHEMBL1574535 0.83 NPC1 (0.52) TP53ALDH1A1POLBRAB9AKMT2A
SCHEMBL1575182 0.83 TP53 (0.78) TP53THRBRAB9AKMT2ANPC1
SCHEMBL1576140 0.83 TP53 (0.78) TP53THRBRAB9AKMT2ANPC1
SCHEMBL1575447 0.83 SMN1; SMN2 (0.57) TP53ALDH1A1POLBRAB9AKDM4E
SCHEMBL1575381 0.82 ALDH1A1 (0.50) THRBALDH1A1POLBRAB9AKDM4E

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 TP53 3220/4885THRB 2620/4885ALDH1A1 1445/4885

“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.