SCHEMBL3175389

SCHEMBL3175389

O=C(O)c1cnoc1-c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 1/20 0.43
TDO2 P48775 1/20 0.42
CDH1 P12830 1/20 0.40
CTNNB1 P35222 1/20 0.40
TCF7L2 Q9NQB0 1/20 0.40
TP53 P04637 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 2/20 0.39
ALOX15 P16050 1/20 0.39
MAPK14 Q16539 1/20 0.39
NOTUM Q6P988 1/20 0.39
CASP1 P29466 1/20 0.39
PTGES O14684 1/20 0.39

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
SCHEMBL9114614 0.85 SMN1; SMN2 (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL544183 0.84 PTPN1 (0.47) NPC1RAB9AALDH1A1TDO2TP53
SCHEMBL3180927 0.83 BCL2L1 (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL3173623 0.83 SMN1; SMN2 (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL343121 0.83 PTPN1 (0.46) ALDH1A1KDM4E
SCHEMBL3178747 0.81 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MAPTTDO2
SCHEMBL20507173 0.81 SLC6A3 (0.51) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL9115919 0.80 RAB9A (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL3541658 0.79 NPC1 (0.48) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL3546598 0.79 ALDH1A1 (0.56) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E

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
US-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS IPS HEART 2018-09-27 US claimed
US-20210054344-A1 CPC EXOSOMES MIRNA373 COMBINATION THERAPIES IPS HEART 2021-02-25 US disclosed
US-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS IPS HEART 2018-09-27 US disclosed
CN-101910160-A Isoxazole derivatives as modulators of 11-beta-hydroxysteroid dehydrogenase type 1 BIOVITRUM AB PUBL 2010-12-08 CN disclosed
EP-2231650-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 Biovitrum AB (publ) (SE) 2010-09-29 EP disclosed
US-7666888-B2 Substituted azole aromatic heterocycles as inhibitors of 11β-HSD-1 AMGEN INC. (US) 2010-02-23 US disclosed
US-20100022590-A1 Novel compounds BIOVITRUM AB (PUBL.) (SE) 2010-01-28 US disclosed
WO-2009090239-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (PUBL) (SE) 2009-07-23 WO disclosed
EP-2051977-A2 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF LLbeta-HSD-1 Amgen Inc. (US) 2009-04-29 EP disclosed
WO-2008011453-A2 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF LLβ-HSD-1 AMGEN INC. (US) 2008-01-24 WO disclosed
US-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 AMGEN INC. 2008-01-24 US 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 (4 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-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 HSD17B1, HSD11B1, HSD17B11 NPC1 1594/4885RAB9A 2914/4885SMN1; SMN2 3710/4885
US-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS EXOSC9, EXOSC5, EXOSC4 NPC1 1167/4885RAB9A 334/4885SMN1; SMN2 14/4885
US-20100022590-A1 Novel compounds HSD11B1, CYP11B1, HSD11B2 NPC1 639/4885RAB9A 2623/4885SMN1; SMN2 3935/4885
US-20210054344-A1 CPC EXOSOMES MIRNA373 COMBINATION THERAPIES EXOSC5, UTRN, EXOSC4 NPC1 2053/4885RAB9A 2257/4885SMN1; SMN2 13/4885

“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.