SCHEMBL14466541

SCHEMBL14466541

c1ccc(-c2nnc(-c3cccc4c(N(c5ccccc5)c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cccc34)o2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.41
SMN1; SMN2 Q16637 10/20 0.41
NPC1 O15118 10/20 0.41
ALDH1A1 P00352 9/20 0.41
KDM4E B2RXH2 7/20 0.41
HPGD P15428 7/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
PTGS2 P35354 4/20 0.37
ATM Q13315 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TSHR P16473 6/20 0.36
HSD17B10 Q99714 3/20 0.35
CYP2C19 P33261 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 4/20 0.35
LMNA P02545 3/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL14466529 0.95 ALDH1A1 (0.42) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL14466537 0.95 RAB9A (0.42) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL14489886 0.93 RAB9A (0.45) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL14465456 0.91 RAB9A (0.40) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL14465458 0.90 RAB9A (0.37) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL10112574 0.89 ALDH1A1 (0.36) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL14466375 0.89 KDM4E (0.47) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL14465673 0.89 RAB9A (0.42) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL1926044 0.88 KDM4E (0.43) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E
SCHEMBL14465395 0.87 RAB9A (0.46) RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9048436-B2 Oxadiazole derivative, and light emitting element, light emitting device, and electronic device using the oxadiazole derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-06-02 US disclosed
US-9048436-B2 Oxadiazole derivative, and light emitting element, light emitting device, and electronic device using the oxadiazole derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-06-02 US disclosed
US-20140299822-A1 Oxadiazole Derivative, and Light Emitting Element, Light Emitting Device, and Electronic Device Using the Oxadiazole Derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-09 US disclosed
US-20140299822-A1 Oxadiazole Derivative, and Light Emitting Element, Light Emitting Device, and Electronic Device Using the Oxadiazole Derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-09 US disclosed
US-8389735-B2 Oxadiazole derivative, and light emitting element, light emitting device, and electronic device using the oxadiazole derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-03-05 US disclosed
US-8389735-B2 Oxadiazole derivative, and light emitting element, light emitting device, and electronic device using the oxadiazole derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-03-05 US disclosed
WO-2007074893-A1 OXADIAZOLE DERIVATIVE, AND LIGHT EMITTING ELEMENT, LIGHT EMITTING DEVICE, AND ELECTRONIC DEVICE USING THE OXADIAZOLE DERIVATIVE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2007-07-05 WO disclosed
US-20070149784-A1 Oxadiazole derivative, and light emitting element, light emitting device, and electronic device using the oxadiazole derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2007-06-28 US disclosed
US-20070149784-A1 Oxadiazole derivative, and light emitting element, light emitting device, and electronic device using the oxadiazole derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2007-06-28 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 (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-20070149784-A1 Oxadiazole derivative, and light emitting element, light emitting device, and electronic device using the oxadiazole derivative OXA1L, ADRA1D, CRY1 RAB9A 3546/4885SMN1; SMN2 2738/4885NPC1 4535/4885

“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.