SCHEMBL6540295

SCHEMBL6540295

O=[N+]([O-])c1ccc(C[C@@H](CO)NCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.58
PTPRF P10586 1/20 0.52
PTPN2 P17706 1/20 0.52
PTPN1 P18031 1/20 0.52
PTPN11 Q06124 1/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
RAB9A P51151 1/20 0.49
CYP2C19 P33261 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.46
MMP2 P08253 1/20 0.46
ADRB1 P08588 1/20 0.45
ADRB3 P13945 1/20 0.45
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL23802828 1.00 LMNA (0.58) LMNAPTPRFPTPN2PTPN1PTPN11
SCHEMBL12454298 0.85 MEN1 (0.53) LMNAPTPRFPTPN2PTPN1PTPN11
SCHEMBL1823141 0.83 SIGMAR1 (0.55) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL23023068 0.83 SIGMAR1 (0.55) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL7041284 0.83 SIGMAR1 (0.55) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5003894 0.82 MEN1 (0.56) LMNAPTPRFPTPN2PTPN1PTPN11
SCHEMBL11410509 0.81 LMNA (0.51) LMNAPTPRFPTPN2PTPN1PTPN11
SCHEMBL10244258 0.81 LMNA (0.62) LMNAMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL10245251 0.81 LMNA (0.62) LMNAMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2797012 0.80 SIGMAR1 (0.68) LMNAPTPRFPTPN2PTPN1PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515896-B1 CHIRAL CYCLEN COMPOUNDS AND THEIR USES UNIV HONG KONG POLYTECHNIC (CN) 2024-08-21 EP disclosed
US-11357873-B2 Chiral cyclen compounds and their uses THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2022-06-14 US disclosed
US-20210283278-A1 CHIRAL CYCLEN COMPOUNDS AND THEIR USES THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2021-09-16 US disclosed
US-6826033-B2 BETA 3 ADRENERGIC RECEPTOR AGONISTS; TREATMENT OF POLLAKIURIA, URINARY INCONTINENCE, OBESITY OR DIABETES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-30 US disclosed
US-20040037022-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-02-26 US disclosed
WO-2002024635-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-28 WO 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-11357873-B2 Chiral cyclen compounds and their uses DCTN3, DCTN1, CDK3 LMNA 2197/4885PTPRF 4637/4885PTPN2 3811/4885
US-20210283278-A1 CHIRAL CYCLEN COMPOUNDS AND THEIR USES DCTN3, DCTN1, CDK3 LMNA 2197/4885PTPRF 4637/4885PTPN2 3811/4885

“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.