SCHEMBL1474419

SCHEMBL1474419

O=C(NCCN1CCOCC1)c1cc(-c2ccco2)on1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.72
KMT2A Q03164 1/20 0.72
RAB9A P51151 6/20 0.69
TSHR P16473 2/20 0.69
ALDH1A1 P00352 6/20 0.67
MAPK1 P28482 2/20 0.67
NPC1 O15118 4/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
TP53 P04637 1/20 0.64
GAA P10253 1/20 0.64
HPGD P15428 1/20 0.64
KDM4E B2RXH2 1/20 0.64
HSD17B10 Q99714 1/20 0.64
HTT P42858 2/20 0.64
HIF1A Q16665 1/20 0.64
CYP1A2 P05177 1/20 0.61
GLA P06280 1/20 0.59

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
SCHEMBL16373567 0.94 HTT (0.74) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL27176294 0.91 RAB9A (0.67) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL1475232 0.90 RAB9A (0.65) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL1477101 0.89 RAB9A (0.67) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL1474268 0.88 RAB9A (0.63) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL1474960 0.87 ALDH1A1 (0.64) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL1475249 0.86 RAB9A (0.58) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL1474285 0.86 RAB9A (0.64) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL1475081 0.85 SMN1; SMN2 (0.60) LMNAKMT2ARAB9ATSHRALDH1A1
SCHEMBL1476638 0.85 ALDH1A1 (0.60) LMNAKMT2ARAB9ATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160151335-A1 METHODS OF MODULATING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. (US) 2016-06-02 US disclosed
US-20160151335-A1 METHODS OF MODULATING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. (US) 2016-06-02 US disclosed
WO-2014210159-A1 METHODS OF MODULATING CFTR ACTIVITY PROTEOSTASIS THERAPEUTICS, INC. (US) 2014-12-31 WO disclosed
EP-1971600-B1 ISOXAZOLE DERIVATIVES AND USE THEREOF SK BIOPHARMACEUTICALS CO LTD (KR) 2013-08-21 EP disclosed
US-20120308608-A1 INTERFERON-INDUCING COMPOUNDS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-12-06 US disclosed
US-20120308608-A1 INTERFERON-INDUCING COMPOUNDS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-12-06 US disclosed
WO-2011094693-A1 INTERFERON-INDUCING COMPOUNDS AND USES THEREOF MOUNT SINAI SCHOOL OF MEDICINE (US) 2011-08-04 WO disclosed
US-7915297-B2 Isoxazole derivatives and use thereof SK HOLDINGS CO., LTD. (KR) 2011-03-29 US disclosed
US-7915297-B2 Isoxazole derivatives and use thereof SK HOLDINGS CO., LTD. (KR) 2011-03-29 US disclosed
US-7915297-B2 Isoxazole derivatives and use thereof SK HOLDINGS CO., LTD. (KR) 2011-03-29 US disclosed
US-20090131336-A1 Isoxazole Derivatives and Use Thereof SK BIOPHARMACEUTICALS CO., LTD. (KR) 2009-05-21 US disclosed
US-20090131336-A1 Isoxazole Derivatives and Use Thereof SK BIOPHARMACEUTICALS CO., LTD. (KR) 2009-05-21 US disclosed
WO-2007078113-A1 ISOXAZOLE DERIVATIVES AND USE THEREOF SK HOLDINGS CO., LTD. (KR) 2007-07-12 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 (3 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-20160151335-A1 METHODS OF MODULATING CFTR ACTIVITY CFTR, HSP90B1, SERPINB1 LMNA 2112/4885KMT2A 4702/4885RAB9A 1564/4885
US-20090131336-A1 Isoxazole Derivatives and Use Thereof WNT3A, WNT1, WNT3 LMNA 2934/4885KMT2A 4661/4885RAB9A 2013/4885
US-20120308608-A1 INTERFERON-INDUCING COMPOUNDS AND USES THEREOF IRF3, IFNG, IFNAR1 LMNA 4460/4885KMT2A 4305/4885RAB9A 3179/4885

“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.