SCHEMBL5034185

SCHEMBL5034185

[O-][S+](c1ccccc1)c1ccccn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.38
GAA P10253 1/20 0.38
LMNA P02545 4/20 0.37
P4HTM Q9NXG6 2/20 0.37
CCR1 P32246 2/20 0.37
CCR5 P51681 2/20 0.37
CCR8 P51685 2/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
METAP1 P53582 1/20 0.37
BLM P54132 1/20 0.37
HIF1A Q16665 1/20 0.37
DOHH Q9BU89 1/20 0.37
L3MBTL1 Q9Y468 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
TDP1 Q9NUW8 3/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34

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
SCHEMBL1573687 0.86 KDM4E (0.43) KDM4EGAALMNAP4HTMCCR1
(Phenylsulfinyl)Benzene SCHEMBL11889251 0.73 CYP3A4 (0.33) TDP1ALDH1A1
SCHEMBL30837415 0.73
SCHEMBL3254805 0.73
SCHEMBL20048805 0.73
SCHEMBL6970710 0.73
SCHEMBL2759539 0.73
SCHEMBL29181146 0.73
(Phenylsulfinyl)Benzene SCHEMBL43199 0.72 TDP1 (0.37) LMNASMN1; SMN2TDP1EHMT2EHMT1
SCHEMBL17036660 0.72 KDM4E (0.36) KDM4EGAALMNAP4HTMCCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118373784-B One-pot preparation method of 2-aryl benzoxazole and asymmetric sulfoxide 江苏师范大学 2024-09-03 CN disclosed
CN-118373784-A One-pot preparation method of 2-aryl benzoxazole and asymmetric sulfoxide 江苏师范大学 2024-07-23 CN disclosed
EP-3784671-A1 DUAL ATM AND DNA-PK INHIBITORS FOR USE IN ANTI-TUMOR THERAPY XRad Therapeutics, Inc. (US) 2021-03-03 EP disclosed
WO-2019201283-A1 DUAL ATM AND DNA-PK INHIBITORS FOR USE IN ANTI-TUMOR THERAPY XRAD THERAPEUTICS, INC. (US) 2019-10-24 WO disclosed
US-20140107343-A1 INDENOPYRIDINE DERIVATIVES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-04-17 US disclosed
US-20140107343-A1 INDENOPYRIDINE DERIVATIVES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-04-17 US disclosed
US-8664372-B2 Process for producing 1,2-trans-glycoside compound GLYTECH, INC. (JP) 2014-03-04 US disclosed
US-20120232256-A1 PROCESS FOR PRODUCING 1,2-TRANS-GLYCOSIDE COMPOUND OTSUKA CHEMICAL CO., LTD. 2012-09-13 US disclosed
US-8212013-B2 Phenyl 3,4,6-tri-O-benzyl-2-O-(1,1,2,2-tetramethyl-dimethylene phosphonoyl)- beta -D-thioglucopyranoside; inhibits formation of o-ester by-product resulting from the conventional glycosilation reaction of pyranose compounds of 1,2-trans form, affording 1,2-transglycoside compounds with high selectivity OTSUKA CHEMICAL CO., LTD. (JP) 2012-07-03 US disclosed
US-20080177049-A1 Process for Producing 1,2-Trans-Glycoside Compound GLYTECH, INC. (JP) 2008-07-24 US disclosed
EP-1849794-A1 PROCESS FOR PRODUCING 1,2-TRANS-GLYCOSIDE COMPOUND Otsuka Chemical Co., Ltd. (JP) 2007-10-31 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 (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-20120232256-A1 PROCESS FOR PRODUCING 1,2-TRANS-GLYCOSIDE COMPOUND ADH1C, ADH1A, CYP2E1 KDM4E 2817/4885GAA 882/4885LMNA 972/4885
US-20080177049-A1 Process for Producing 1,2-Trans-Glycoside Compound ADH1C, ADH1A, CYP2E1 KDM4E 2817/4885GAA 882/4885LMNA 972/4885
US-20140107343-A1 INDENOPYRIDINE DERIVATIVES HSD11B1, HSD3B1, HSD11B2 KDM4E 3419/4885GAA 1535/4885LMNA 4100/4885

“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.